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10967/161 - QDB Compounds

QsarDB Repository

Kahn, I.; Lomaka, A.; Karelson, M. Topological Fingerprints as an Aid in Finding Structural Patterns for LRRK2 Inhibition. Mol. Inf. 2014, 33, 269-275.

198 compounds | Property pKi: LRRK2 inhibition as log(1/Ki)

ID Name pKi Details
CHEMBL101311 1-[4-[[4-(2,5-dichloroanilino)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol 5.9 View
CHEMBL1081312 1-cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine 7.2 View
CHEMBL1084546 N-methyl-N-[3-[[[2-[(2-oxo-1,3-dihydroindol-5-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]methyl]pyridin-2-yl]methanesulfonamide 6.8 View
CHEMBL1164180 1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-7-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazine 5.7 View
CHEMBL117697 N-(3-methoxyphenyl)quinazolin-4-amine 5.1 View
CHEMBL1178727 4H-indeno[1,2-d][1,3]thiazol-2-amine 4.5 View
CHEMBL1233887 6-(5-methoxy-1-methylindol-3-yl)-5H-pyrrolo[2,3-b]pyrazine 6.3 View
CHEMBL1421720 N-(1,3-benzothiazol-2-yl)-2-thiophen-2-ylacetamide 6.1 View
CHEMBL1825138 3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine 5.7 View
CHEMBL1870106 [2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-7-yl]-(3-aminopyrrolidin-1-yl)methanone 6.2 View
CHEMBL189963 6-acetyl-8-cyclopentyl-5-methyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one 5.6 View
CHEMBL191003 4-[[5-amino-1-(2,6-difluorobenzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide 7.1 View
CHEMBL1949855 8-chloro-1H-quinazolin-4-one 5.8 View
CHEMBL1964382 2-bromo-4-[2-(3-bromo-4-hydroxy-5-iodophenyl)propan-2-yl]-6-iodophenol 5.6 View
CHEMBL1964441 1-[4-[4-amino-7-[3-(methylamino)prop-1-ynyl]thieno[3,2-c]pyridin-3-yl]phenyl]-3-(3-methylphenyl)urea 6 View
CHEMBL1964718 7-methyl-2,4-dihydropyrido[2,1-c][1,2,4]triazin-3-one 4.5 View
CHEMBL1965660 5-(2-aminopyrimidin-4-yl)-2-(2,4-dichlorophenyl)-1H-pyrrole-3-carboxamide 6.5 View
CHEMBL1966799 5-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-amine 4 View
CHEMBL1967252 3-methyl-5-pyridin-3-yl-2H-indazole 6.4 View
CHEMBL1967612 5-chloro-1,1-dioxo-1,2-benzothiazol-3-one 4.3 View
CHEMBL1967878 3-[[5-fluoro-2-[3-methyl-4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]bicyclo[2.2.1]hept-5-ene-2-carboxamide 9.2 View
CHEMBL1967992 2-(benzylamino)-4-pyridin-4-ylbenzonitrile 6.1 View
CHEMBL1967998 5-chloro-2-N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-N-(1H-indazol-5-yl)pyrimidine-2,4-diamine 7.5 View
CHEMBL1968130 5-chloro-[1,2,4]triazolo[4,3-a]pyrazin-3-amine 4.3 View
CHEMBL1969151 1-N-[4-chloro-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]-4-N,4-N-dimethylcyclohexane-1,4-diamine 7.8 View
CHEMBL1970317 1-[4-[4-amino-7-(1-methylpyrazol-4-yl)thieno[3,2-c]pyridin-3-yl]phenyl]-3-(3-fluorophenyl)urea 6.5 View
CHEMBL1970352 ethyl 5-hydroxy-1-(4-iodophenyl)-2-methylbenzo[g]indole-3-carboxylate 5.6 View
CHEMBL1970873 8-methyl-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one 4.1 View
CHEMBL1971289 2-amino-5-[(4-ethoxy-2-hydroxyphenyl)methylidene]-1,3-thiazol-4-one 6.3 View
CHEMBL1971519 4-(4-fluorophenyl)-1H-indazol-3-amine 5.9 View
CHEMBL1971534 thieno[2,3-c]pyridine-2-carboxamide 5 View
CHEMBL1972220 1-[4-[4-amino-7-[1-(2-hydroxyethyl)pyrazol-4-yl]thieno[3,2-c]pyridin-3-yl]phenyl]-3-[4-(difluoromethoxy)phenyl]urea 7.6 View
CHEMBL1972346 4-[2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,2-diol 6.3 View
CHEMBL1972355 6-(1,3-dihydrobenzimidazol-2-ylidene)-5-methoxy-2-methylchromene-4,7-dione 6.1 View
CHEMBL1972934 thieno[2,3-d]pyrimidin-4-amine 4.9 View
CHEMBL1973013 5-bromo-4-N-(5-methyl-1,3-thiazol-2-yl)-2-N-propan-2-ylpyrimidine-2,4-diamine 6.3 View
CHEMBL1973516 2-[4-(4-ethylpiperazin-1-yl)anilino]-4-(1H-indazol-5-ylamino)pyrimidine-5-carbonitrile 6.6 View
CHEMBL1973720 4-N-[4-chloro-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]cyclohexane-1,4-diamine 8.7 View
CHEMBL1973793 3-bromo-N-(9-hydroxyiminofluoren-2-yl)benzenesulfonamide 6.1 View
CHEMBL1973868 6-pyridin-4-ylquinolin-3-ol 6 View
CHEMBL1974328 5-[(2-aminocyclohexyl)amino]-3-(3-methylanilino)pyrazine-2-carboxamide 7.9 View
CHEMBL1974617 [5-(1H-indazol-5-yl)-1,2-oxazol-3-yl]methanol 5.4 View
CHEMBL1974875 5-oxo-1,2,3,4-tetrahydrothieno[3,2-e][1,4]diazepine-8-carboxylic acid 4.7 View
CHEMBL1975212 5-phenylthieno[2,3-d]pyrimidin-4-amine 5.2 View
CHEMBL1975921 6-bromo-1,3-dihydroimidazo[4,5-b]pyridin-2-one 5.4 View
CHEMBL1975927 7-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyrrolo[2,3-d]pyrimidin-2-amine 7.6 View
CHEMBL1976040 1-[6-(2-hydroxypropan-2-yl)pyridin-2-yl]-6-[4-(4-methylpiperazin-1-yl)anilino]-2-prop-2-enylpyrazolo[3,4-d]pyrimidin-3-one 6.4 View
CHEMBL1976420 2-[4-(7-ethyl-5H-pyrrolo[2,3-b]pyrazin-6-yl)phenyl]propan-2-ol 6.2 View
CHEMBL1976872 N-pyrazolo[1,5-a]pyridin-2-ylacetamide 4.6 View
CHEMBL1977138 3-[6-[1-(2-fluorophenyl)ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile 7.8 View
CHEMBL1977749 N-(2-phenyl-8-prop-2-enylchromen-4-ylidene)hydroxylamine 6.8 View
CHEMBL1977931 1-[2-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)phenyl]ethanone 4.9 View
CHEMBL1978166 1-[4-[4-amino-7-(10-aminodec-1-ynyl)thieno[3,2-c]pyridin-3-yl]phenyl]-3-(3-methylphenyl)urea 6.2 View
CHEMBL1978167 2-bromo-6-(1-methylindol-3-yl)-5H-pyrrolo[2,3-b]pyrazine 5.9 View
CHEMBL1978195 4-(4-bromophenyl)thieno[2,3-c]pyridine-2-carboxamide 6.7 View
CHEMBL1979690 5-chloro-4-N-(1H-indazol-5-yl)-2-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidine-2,4-diamine 7.8 View
CHEMBL1980329 6-(4-hydroxyphenyl)-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one 8.1 View
CHEMBL1980391 5-(2-chlorophenyl)-7-fluoro-8-methoxy-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine 6.9 View
CHEMBL1980407 5-[5-(2-amino-3-phenylpropoxy)pyridin-3-yl]-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one 8.2 View
CHEMBL1980763 N-(3-chloro-4-morpholin-4-ylphenyl)-4-(2-methylpropyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine 7.6 View
CHEMBL1980995 3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,16,19,21,23,25,27-decaen-16-ol 9.4 View
CHEMBL1981047 N-[5-(2-methoxy-2-phenylacetyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-4-(4-methylpiperazin-1-yl)benzamide 6.1 View
CHEMBL1981133 1-(1H-indol-3-yl)-3-(5-isoquinolin-6-ylpyridin-3-yl)oxypropan-2-amine 6 View
CHEMBL1981492 methyl 2-aminoimidazo[1,2-a]pyridine-3-carboxylate 5.6 View
CHEMBL1982711 4-(4-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)benzamide 7 View
CHEMBL1983268 N-[5-[(3,5-difluorophenyl)methyl]-1H-indazol-3-yl]-4-(4-methylpiperazin-1-yl)-2-(oxan-4-ylamino)benzamide 5.6 View
CHEMBL1983348 N-butyl-N-(2-cyanoethyl)-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide 7.3 View
CHEMBL1983575 1-[(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenylurea 7.2 View
CHEMBL1983630 5-phenyl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one 4.7 View
CHEMBL1983715 1-[4-[4-[[4-[2-(ethylamino)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanone 7.7 View
CHEMBL1983923 6-(4-methylpiperazin-1-yl)-N-(5-methyl-1H-pyrazol-3-yl)-2-(2-phenylethenyl)pyrimidin-4-amine 6.7 View
CHEMBL1983980 2-[8-(1,3-benzothiazol-2-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-[4-(hydroxymethyl)phenyl]-1,3-thiazole-4-carboxylic acid 6.2 View
CHEMBL1984296 N-(2,5-dimethylphenyl)-2-(furan-2-yl)quinoline-4-carboxamide 5.8 View
CHEMBL1984402 5-acetyl-4-amino-2-methyl-6-phenylpyridazin-3-one 4.1 View
CHEMBL1984500 4-bromo-2,3-dihydroisoindol-1-one 4.5 View
CHEMBL1984760 N-propyl-4-[[4-(3,3,3-trifluoropropyl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide 7.3 View
CHEMBL1985042 4-methyl-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,6-dione 4.4 View
CHEMBL1985206 5-(3-methoxyprop-1-ynyl)-3-thiophen-2-yl-2,4-dihydroindeno[1,2-c]pyrazole 6 View
CHEMBL1986590 3-(1H-indol-3-ylmethylidene)-1H-indol-2-one 6.2 View
CHEMBL1986943 4-[[4-chloro-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol 8.1 View
CHEMBL1987535 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(2-thiophen-2-ylethyl)-3,6-dihydro-2H-pyridine-1-carboxamide 6.2 View
CHEMBL1988076 N-[3-[5-[2-(2-methylanilino)pyrimidin-4-yl]imidazo[2,1-b][1,3]thiazol-6-yl]phenyl]benzamide 5.6 View
CHEMBL1988437 N-methyl-2-[[3-(2-pyridin-2-ylethenyl)-1H-indazol-6-yl]sulfanyl]benzamide 7.7 View
CHEMBL1988581 8-[(dimethylamino)methyl]-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one 7 View
CHEMBL1988622 6-(2-phenylethenyl)imidazo[1,2-b]pyridazine 5.4 View
CHEMBL1988692 4-(indol-2-ylidenemethyl)-5-(propan-2-ylamino)-1,2-dihydropyrazol-3-one 6.5 View
CHEMBL1988805 2-amino-3-(1,3-thiazol-2-yl)benzimidazole-5-carbonitrile 6.6 View
CHEMBL1989267 N-[4-[4-amino-7-[3-[2-(dimethylamino)ethylamino]-3-oxoprop-1-enyl]thieno[3,2-c]pyridin-3-yl]-2-methoxyphenyl]-1-methylindole-2-carboxamide 5.7 View
CHEMBL1989423 1,4-dihydroindeno[1,2-c]pyrazole 5 View
CHEMBL1989471 4-methyl-8-propan-2-yl-10H-benzo[b][1,8]naphthyridin-5-one 6 View
CHEMBL1991078 N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]-3,4-dimethoxybenzamide 6.3 View
CHEMBL1991410 N-[6-chloro-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyridin-2-yl]-2,6-difluorobenzamide 5.7 View
CHEMBL1991674 4-[[6-chloro-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]cyclohexan-1-ol 7.5 View
CHEMBL1991734 10-methyl-9-phenyl-9H-acridine-2,7-diamine 6.6 View
CHEMBL1991867 5-chloro-2H-pyrazolo[3,4-d][1,3]thiazol-3-amine 4.8 View
CHEMBL1992073 N-(3-ethyl-4-{1,5,7,11-tetraazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl}cyclopentyl)cyclopropanesulfonamide 7 View
CHEMBL1992125 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine 5.6 View
CHEMBL1992581 N-[4-(difluoromethylsulfanyl)phenyl]-2-(4-pyridin-3-ylphenyl)acetamide 5.8 View
CHEMBL1992607 4-amino-6,7,8,9-tetrahydropyrimido[4,5-e][1,4]diazepin-5-one 4.5 View
CHEMBL1992673 9-chloro-3H-[1,2,4]triazolo[1,5-c]quinazolin-5-one 4.4 View
CHEMBL1992937 N-(5-methylpyridin-2-yl)-6-nitro-1H-benzimidazol-2-amine 6.1 View
CHEMBL1993335 2-bromo-6-(5-fluoro-1-methylindol-3-yl)-5H-pyrrolo[2,3-b]pyrazine 6.4 View
CHEMBL1993661 2-[[5-chloro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]-N-methylbenzenesulfonamide 9.5 View
CHEMBL1993877 7-cyclopentyl-5-ethynylpyrrolo[2,3-d]pyrimidin-4-amine 7 View
CHEMBL1993904 7-amino-4-[4-(1,3-benzoxazol-2-ylamino)phenyl]thieno[2,3-c]pyridine-2-carboxamide 6.8 View
CHEMBL1994318 N-(3-aminopropyl)-3-[3-tert-butyl-5-(naphthalen-1-ylcarbamoylamino)pyrazol-1-yl]-N-propan-2-ylbenzamide 5.7 View
CHEMBL1994526 4-(1-aminoethyl)-N-pyridin-4-ylcyclohexane-1-carboxamide 6.1 View
CHEMBL1994555 1-[4-(7-ethyl-5H-pyrrolo[2,3-b]pyrazin-6-yl)phenyl]ethanone 5.7 View
CHEMBL1994808 3-methyl-6-phenyl-1,2,4-triazine-5-carbonitrile 4.1 View
CHEMBL1995211 N-tert-butyl-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine 6.8 View
CHEMBL1995811 N-[5-(1-benzyltriazol-4-yl)-1H-indazol-3-yl]-2,5-difluorobenzamide 5.9 View
CHEMBL1995916 N-methyl-3-phenyl-1H-pyrazole-5-carboxamide 4.3 View
CHEMBL1996048 4-(2-aminoethylamino)-2-(4-methylphenyl)-1H-indole-7-carboxamide 6.8 View
CHEMBL1996176 3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one 6.3 View
CHEMBL1996510 3-(1H-indol-3-yl)-4-(2-piperazin-1-ylquinazolin-4-yl)pyrrole-2,5-dione 6.4 View
CHEMBL1996646 6-chloro-2-N-cyclohexyl-4-N-[(2,6-dimethoxyphenyl)methyl]quinazoline-2,4-diamine 5.9 View
CHEMBL1996649 4-amino-N-[3-(diethylamino)propyl]-3-[4-[(3-fluorophenyl)carbamoylamino]phenyl]thieno[3,2-c]pyridine-7-carboxamide 6 View
CHEMBL1996702 N-[3-(dimethylamino)propyl]-9-(4-hydroxy-3-methoxyphenyl)-6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide 5.7 View
CHEMBL1997007 4-[(4-ethyl-7H-pyrrolo[2,3-d]pyrimidin-2-yl)amino]-N-propylbenzamide 7.5 View
CHEMBL1997041 4-(4-fluoro-3-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidine 6.4 View
CHEMBL1997119 5-phenylimidazo[1,5-a]pyridin-3-amine 4.5 View
CHEMBL1997611 ethyl 8-acetamido-1-methyl-7-nitro-4-oxo-5H-imidazo[1,2-a]quinoxaline-2-carboxylate 5.7 View
CHEMBL1997846 6-chloro-N-cyclohexyl-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-amine 5.6 View
CHEMBL1997924 2-N-benzyl-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)thieno[3,2-d]pyrimidine-2,4-diamine 8 View
CHEMBL1998470 N-[6-chloro-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyridin-2-yl]butanamide 6.7 View
CHEMBL1998953 5-phenyl-4-piperidin-1-yl-7H-pyrrolo[2,3-d]pyrimidine 7.7 View
CHEMBL1999120 4-propan-2-yl-2,7-dihydro-1H-pyrazolo[3,4-b]pyridine-3,6-dione 4.4 View
CHEMBL1999414 4-amino-N-[3-(diethylamino)propyl]-3-[4-[(3-methylphenyl)carbamoylamino]phenyl]thieno[3,2-c]pyridine-7-carboxamide 5.9 View
CHEMBL1999484 N,4-dimethyl-5-[2-(4-piperazin-1-ylanilino)pyrimidin-4-yl]-1,3-thiazol-2-amine 7.3 View
CHEMBL2000029 5-[1-benzyl-5-(2-methylphenyl)triazol-4-yl]-1H-indazol-3-amine 7.4 View
CHEMBL2000568 1-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]ethanone 6.8 View
CHEMBL2000879 5-phenyl-4,5,6,7-tetrahydro-1H-indazole 4.1 View
CHEMBL2001613 5-bromo-1,2-dihydroindazol-3-one 5.4 View
CHEMBL2001641 2-[1-(1H-indazol-5-yl)triazol-4-yl]propan-2-ol 4.9 View
CHEMBL2001704 [1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-amine 4.1 View
CHEMBL2002099 3-cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propanenitrile 7 View
CHEMBL2002105 5-bromo-2H-pyrazolo[3,4-b]pyridin-3-amine 5.5 View
CHEMBL2002182 8-phenyl-2H-[1,2,4]triazolo[4,3-a]pyridin-3-one 4.4 View
CHEMBL2002992 4-(1-aminoethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)cyclohexane-1-carboxamide 7.7 View
CHEMBL2004033 3-bromo-1H-pyrazolo[1,5-a]pyridin-2-one 5.6 View
CHEMBL2004290 1-[4-[4-amino-7-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]thieno[3,2-c]pyridin-3-yl]phenyl]-3-(4-methoxyphenyl)urea 6.3 View
CHEMBL2004515 4-(1,3-benzodioxol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine 6.4 View
CHEMBL2005449 4-N-benzyl-6-chloro-2-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine 5.8 View
CHEMBL2005478 2-bromo-6-(5-methoxy-1-methylindol-3-yl)-5H-pyrrolo[2,3-b]pyrazine 6 View
CHEMBL2006564 N-[4-[[6-(cyclopropylamino)-7H-purin-2-yl]amino]phenyl]-N-ethylacetamide 8.9 View
CHEMBL2006765 N-propyl-4-[[4-(2,2,2-trifluoroethylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide 9.1 View
CHEMBL2007421 5-chloro-2-N-[1-(5-fluoropyridin-2-yl)ethyl]-4-N-(3-propan-2-yloxy-1H-pyrazol-5-yl)pyrimidine-2,4-diamine 6 View
CHEMBL2007559 N-propyl-4-[[4-(2,2,2-trifluoroethylamino)thieno[3,2-d]pyrimidin-2-yl]amino]benzamide 7.4 View
CHEMBL2007574 4-chloro-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine 7.1 View
CHEMBL21156 4-tert-butyl-15-fluoro-3,5,10-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),3,7(12),8,10,14,16-octaen-11-ol 7.6 View
CHEMBL235157 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline-7,10-diamine 7.2 View
CHEMBL242865 2-[[2-(4-nitroanilino)pyrimidin-4-yl]amino]benzoic acid 5.8 View
CHEMBL24828 N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine 5.7 View
CHEMBL289959 N-phenylquinazolin-4-amine 4.7 View
CHEMBL379975 4-(2-chlorophenyl)-9-hydroxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione 7 View
CHEMBL38380 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline 5.7 View
CHEMBL422897 2-(2-chlorophenyl)-5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)chromen-4-one 6 View
CHEMBL451401 1H-indazole-7-carboxamide 4.8 View
CHEMBL458997 2-[[5-chloro-2-(2-methoxy-4-morpholin-4-ylanilino)pyrimidin-4-yl]amino]-N-methylbenzamide 8.6 View
CHEMBL475251 6-[[5-fluoro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]-2,2-dimethyl-4H-pyrido[3,2-b][1,4]oxazin-3-one 7.5 View
CHEMBL482538 4-phenyl-1H-pyrrolo[2,3-b]pyridine 6 View
CHEMBL483158 4-[[9-chloro-7-(2-fluoro-6-methoxyphenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]-2-methoxybenzoic acid 6.1 View
CHEMBL49120 6-(2,6-dichlorophenyl)-2-[4-[2-(diethylamino)ethoxy]anilino]-8-methylpyrido[2,3-d]pyrimidin-7-one 6.6 View
CHEMBL521851 4-[2-(1H-indazol-4-yl)-6-[(4-methylsulfonylpiperazin-1-yl)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine 5.6 View
CHEMBL522892 4-amino-5-fluoro-3-[5-(4-methylpiperazin-1-yl)-1,3-dihydrobenzimidazol-2-ylidene]quinolin-2-one 6.5 View
CHEMBL550418 1-hydroxy-9-(4-hydroxy-3-methoxyphenyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one 5.8 View
CHEMBL565612 3-(1H-indol-3-yl)-4-[2-(4-methylpiperazin-1-yl)quinazolin-4-yl]pyrrole-2,5-dione 5.9 View
CHEMBL572878 N-[4-[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]cyclopropanecarboxamide 6.2 View
CHEMBL574738 1-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[4-[6-(methylamino)pyrimidin-4-yl]oxyphenyl]urea 6 View
CHEMBL592030 5-(3-aminopropyl)-7-[7-(1-benzothiophen-2-yl)-1H-indazol-5-yl]pyrrolo[3,2-d]pyrimidin-2-amine 6.6 View
CHEMBL1727312 5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one 4.5 View
CHEMBL1879463 2-methyl-2-[4-(3-methyl-2-oxo-8-quinolin-3-ylimidazo[4,5-c]quinolin-1-yl)phenyl]propanenitrile 6 View
CHEMBL1964948 3-[3-tert-butyl-5-(naphthalen-1-ylcarbamoylamino)pyrazol-1-yl]-N-[3-(dimethylamino)propyl]-N-methylbenzamide 6.3 View
CHEMBL1965838 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine 4.4 View
CHEMBL1966175 3-(4-methyl-3-{1,5,7,11-tetraazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl}piperidin-1-yl)-3-oxopropanenitrile 6.5 View
CHEMBL1970340 3-(3-amino-1,2-benzoxazol-4-yl)phenol 5.5 View
CHEMBL1973359 2-(5-nitrofuran-2-yl)imidazo[1,2-a]pyridine-6-carboxamide 6.9 View
CHEMBL1975903 4-(2-methoxyphenyl)-N-(3-methylsulfonylphenyl)pyrimidin-2-amine 6.2 View
CHEMBL1978713 3-amino-N-[(4-methoxyphenyl)methyl]-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide 6 View
CHEMBL1980297 1-[4-[4-amino-7-[1-(2-hydroxyethyl)pyrazol-4-yl]thieno[3,2-c]pyridin-3-yl]phenyl]-3-(3-fluorophenyl)urea 7.6 View
CHEMBL1980376 4-(3-methylphenyl)-1,2-benzoxazol-3-amine 4.8 View
CHEMBL1982753 6-[(2-aminocyclohexyl)amino]-2-(3-chloroanilino)pyridine-3-carboxamide 7 View
CHEMBL1983111 N-[2-(4-{[6-(cyclobutylimino)-5-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl]amino}-11-azatricyclo[6.2.1.02,7]undeca-2(7),3,5-trien-11-yl)-2-oxoethyl]ethanimidic acid 9.2 View
CHEMBL1985681 3-(5-hydroxy-5,6,7,8-tetrahydroquinolin-2-yl)-2-oxo-1,3-dihydroindole-5-carbonitrile 5.9 View
CHEMBL1989708 1-[4-[4-amino-7-[1-(2-hydroxypropyl)pyrazol-4-yl]thieno[3,2-c]pyridin-3-yl]phenyl]-3-(3-methylphenyl)urea 7.2 View
CHEMBL1992371 1-(1,4-dihydropyrazin-2-yl)-3-(5-oxonaphthalen-1-ylidene)urea 5.8 View
CHEMBL1994159 1-(3-imidazo[1,2-b]pyridazin-6-ylphenyl)ethanone 4.2 View
CHEMBL1995765 3-amino-2-pyridin-2-yl-1H-pyrazol-5-one 5.2 View
CHEMBL1997051 N-[3-[5-[2-[5-[(dimethylamino)methyl]-2-methoxyanilino]pyrimidin-4-yl]imidazo[2,1-b][1,3]thiazol-6-yl]phenyl]-2,6-difluorobenzamide 5.6 View
CHEMBL1997335 4-(3,4-dimethoxyphenyl)-8-methoxy-2,3-diazatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,8,10-hexaene 6.6 View
CHEMBL2001149 2-[4-[4-(6-hydroxy-1H-benzimidazol-2-yl)phenyl]sulfanylphenyl]-3H-benzimidazol-5-ol 6.3 View
CHEMBL2002586 2-N-(3-chloro-4-morpholin-4-ylphenyl)-4-N-cyclopropylthieno[3,2-d]pyrimidine-2,4-diamine 7.5 View
CHEMBL2003785 N-[(3-fluorophenyl)methyl]-7H-purin-6-amine 5.7 View
CHEMBL2004118 N-(3-chloro-4-morpholin-4-ylphenyl)-4-ethyl-7H-pyrrolo[2,3-d]pyrimidin-2-amine 7.8 View
CHEMBL225519 2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one 6.1 View
CHEMBL234085 3-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile 6.7 View
CHEMBL262623 6-phenyl-8,9-dihydro-7H-pyrimido[4,5-b][1,4]diazepin-4-amine 5.7 View
CHEMBL461876 2-[[2-[[1-[2-(dimethylamino)acetyl]-5-methoxy-2,3-dihydroindol-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-6-fluorobenzamide 8.1 View

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