TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T20891 Phosphoinositide dependent protein kinase-1 D0J9ZR Niclosamide Approved 4477 C13H8Cl2N2O4 327.12 C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC(=O)C2=C(C=CC(=C2)Cl)O IC50 = 83900 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B03ASL N-[3-(Benzimidazol-2-ylidene)-1,2-dihydroindazol-5-yl]-1-pyridin-4-ylpiperidine-4-carboxamide Investigative 136232555 C25H23N7O 437.5 C1CN(CCC1C(=O)NC2=CC3=C(C=C2)NN=C3C4=NC5=CC=CC=C5N4)C6=CC=NC=C6 IC50 ~ 100000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B09EWP 2,2-Difluoro-N-(3-(6-morpholino-1H-benzo[d]imidazol-2-yl)-1H-indazol-6-yl)cyclopropanecarboxamide Investigative 136232556 C22H20F2N6O2 438.4 C1COCCN1C2=CC3=C(C=C2)N=C(N3)C4=NNC5=C4C=CC(=C5)NC(=O)C6CC6(F)F IC50 ~ 100000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B0ZK9H N-(3-(1H-Benzo[d]imidazol-2-yl)-1H-indazol-5-yl)-1,4-dimethylpiperidine-4-carboxamide Investigative 136232553 C22H24N6O 388.5 CC1(CCN(CC1)C)C(=O)NC2=CC3=C(C=C2)NN=C3C4=NC5=CC=CC=C5N4 IC50 ~ 100000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B1FXU3 6-Tert-Butyl-3H-thieno[3,2-d]pyrimidin-4-one Investigative 135400705 C10H12N2OS 208.28 CC(C)(C)C1=CC2=C(S1)C(=O)NC=N2 IC50 = 55000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B1P2TA 4-[[(1S)-2-[Cyclopropyl(methyl)amino]-1-phenylethyl]amino]-6,7-dihydroquinazoline-8-carboxamide Investigative 68079076 C21H25N5O 363.5 CN(C[C@H](C1=CC=CC=C1)NC2=NC=NC3=C(CCC=C32)C(=O)N)C4CC4 IC50 = 74000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B34JHE 10-[[(1S)-1-Cyclohexa-2,4-dien-1-yl-2-[ethyl(propan-2-yl)amino]ethyl]amino]-1,3-diazecine-5-carboxamide Investigative 68078758 C22H31N5O 381.5 CCN(C[C@H](C1CC=CC=C1)NC2=CC=CC=C(C=NC=N2)C(=O)N)C(C)C IC50 = 95000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B3V7WM 4-[1-(3,5-Difluorophenyl)ethylamino]quinazoline-8-carboxamide Investigative 66763261 C17H14F2N4O 328.32 CC(C1=CC(=CC(=C1)F)F)NC2=NC=NC3=C2C=CC=C3C(=O)N IC50 = 61000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B40TSW 2-(2-Oxo-3-phenylsulfanyl-4,5-dihydro-3H-1-benzazepin-1-yl)acetic acid Investigative 49798471 C18H17NO3S 327.4 C1CC2=CC=CC=C2N(C(=O)C1SC3=CC=CC=C3)CC(=O)O EC50 = 101000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B4G7OT 4-Amino-1H-pyrazole-5-carboxamide Investigative 580973 C4H6N4O 126.12 C1=NNC(=C1N)C(=O)N IC50 = 200000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B4MB1G 2-Phenylthiazole Investigative 547494 C9H7NS 161.23 C1=CC=C(C=C1)C2=NC=CS2 IC50 = 95100 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B51RCZ 6-Bromo-1H-indazol-3-amine Investigative 2786631 C7H6BrN3 212.05 C1=CC2=C(C=C1Br)NN=C2N IC50 = 82400 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B52SKF 3-(1H-Benzimidazol-2-yl)-5-[4-(2-isocyanopropan-2-yl)phenyl]-1H-indazole Investigative 136232551 C24H19N5 377.4 CC(C)(C1=CC=C(C=C1)C2=CC3=C(C=C2)NN=C3C4=NC5=CC=CC=C5N4)[N+]#[C-] IC50 = 58500 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B6AU9M 6-(4-Fluorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one Investigative 135463111 C12H7FN2OS 246.26 C1=CC(=CC=C1C2=CC3=C(S2)C(=O)NC=N3)F IC50 = 122000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B6PHU1 3,4-Dihydroisoquinolin-1(2H)-one Investigative 150896 C9H9NO 147.17 C1CNC(=O)C2=CC=CC=C21 IC50 = 169000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B6V7XL N-[(3-Chloro-6-hydroxy-2,4-dimethylphenyl)carbamothioyl]-3,5-dimethylbenzamide Investigative 56644474 C18H19ClN2O2S 362.9 CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C(=C2C)Cl)C)O)C IC50 = 106800 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B85DFN 5-Phenyl[1,2,4]triazolo[1,5-c]quinazolin-2-amine Investigative 794624 C15H11N5 261.279 C1=CC=C(C=C1)C2=NC3=CC=CC=C3C4=NC(=NN24)N IC50 = 60000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B85ICH 4-[2-(1H-Indol-3-yl)ethylamino]quinazoline-8-carboxamide Investigative 46868959 C19H17N5O 331.4 C1=CC=C2C(=C1)C(=CN2)CCNC3=NC=NC4=C3C=CC=C4C(=O)N IC50 = 79000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B8KU3T Acetic acid, 2-[[3-(4-chlorophenyl)-3-oxo-1-phenylpropyl]thio]- Investigative 2728593 C17H15ClO3S 334.8 C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Cl)SCC(=O)O EC50 = 133000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B8OGP4 4-[(2-Imidazol-1-yl-1-phenylethyl)amino]quinazoline-8-carboxamide Investigative 66763023 C20H18N6O 358.4 C1=CC=C(C=C1)C(CN2C=CN=C2)NC3=NC=NC4=C3C=CC=C4C(=O)N IC50 = 89000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B8UQX5 Thieno[3,2-d]pyrimidin-4(3H)-one, 7-(dimethylamino)- Investigative 136254213 C8H9N3OS 195.24 CN(C)C1=CSC2=C1N=CNC2=O IC50 = 109000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B8WYL3 4-[[3-[[4-Methoxy-3-(trifluoromethyl)benzoyl]amino]phenyl]methylamino]quinazoline-8-carboxamide Investigative 66762835 C25H20F3N5O3 495.5 COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)CNC3=NC=NC4=C3C=CC=C4C(=O)N)C(F)(F)F IC50 = 87000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B8ZRO5 N-(4-Methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine Investigative 845961 C12H11N5O 241.25 COC1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3 IC50 = 61000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B9H4QF 1-[[3-[[4-(4-Methylpiperazin-1-yl)-3-(trifluoromethyl)benzoyl]amino]phenyl]methylamino]phthalazine-5-carboxamide Investigative 68078770 C29H28F3N7O2 563.6 CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)CNC4=C5C=CC=C(C5=CN=N4)C(=O)N)C(F)(F)F IC50 = 82000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B9MXJ1 4-[[3-[(4-Methylsulfonylbenzoyl)amino]phenyl]methylamino]quinazoline-8-carboxamide Investigative 66763053 C24H21N5O4S 475.5 CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)CNC3=NC=NC4=C3C=CC=C4C(=O)N IC50 = 97000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 B9ONA3 2-[3-(2,4-Dichlorophenyl)sulfanyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Investigative 49798542 C18H15Cl2NO3S 396.3 C1CC2=CC=CC=C2N(C(=O)C1SC3=C(C=C(C=C3)Cl)Cl)CC(=O)O EC50 = 75000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BBX6F1 [1-Phenyl-3-oxo-3-[4-(trifluoromethyl)phenyl]propyl]malonic acid Investigative 66760004 C19H15F3O5 380.3 C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)C(F)(F)F)C(C(=O)O)C(=O)O EC50 = 85800 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BC7MD5 5-Bromo-1H-indazol-3-amine Investigative 817910 C7H6BrN3 212.05 C1=CC2=C(C=C1Br)C(=NN2)N IC50 = 101900 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BCIO21 4-[1-[3-[[4-(Trifluoromethoxy)benzoyl]amino]phenyl]ethylamino]quinazoline-8-carboxamide Investigative 66762825 C25H20F3N5O3 495.5 CC(C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)OC(F)(F)F)NC3=NC=NC4=C3C=CC=C4C(=O)N IC50 = 86000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BD0J7P 2,6-Diaminopurine Investigative 30976 C5H6N6 150.14 C1=NC2=NC(=NC(=C2N1)N)N IC50 = 50800 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BD3AB8 4-[(3,4,5-Trifluorophenyl)methylamino]quinazoline-8-carboxamide Investigative 66763190 C16H11F3N4O 332.28 C1=CC2=C(C(=C1)C(=O)N)N=CN=C2NCC3=CC(=C(C(=C3)F)F)F IC50 = 102000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BD81OH N-[(3-Chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]benzamide Investigative 3664359 C14H10ClN3O4S 351.8 C1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=CC(=C2)[N+](=O)[O-])Cl)O IC50 = 66700 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BD87AY 4-[5-(1H-Indol-3-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Investigative 135434049 C18H13F3N4O2S 406.4 C1=CC=C2C(=C1)C(=CN2)C3=CC(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F IC50 = 65000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BDB6Y2 2-(3-(4-Methoxyphenylthio)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetic acid Investigative 49798540 C19H19NO4S 357.4 COC1=CC=C(C=C1)SC2CCC3=CC=CC=C3N(C2=O)CC(=O)O EC50 = 53000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BECG08 6-(4-Fluorophenyl)-7-methyl-3H-thieno[3,2-d]pyrimidin-4-one Investigative 136254216 C13H9FN2OS 260.29 CC1=C(SC2=C1N=CNC2=O)C3=CC=C(C=C3)F IC50 = 106000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BEF80I 4-[[3-[(2-Piperidin-1-ylpyridine-4-carbonyl)amino]phenyl]methylamino]quinazoline-8-carboxamide Investigative 68078742 C27H27N7O2 481.5 C1CCN(CC1)C2=NC=CC(=C2)C(=O)NC3=CC=CC(=C3)CNC4=NC=NC5=C4C=CC=C5C(=O)N IC50 = 83000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BEIH54 1-(3-(1H-Benzo[d]imidazol-2-yl)-1H-indazol-5-yl)-3-(2,4-difluorophenyl)urea Investigative 136232552 C21H14F2N6O 404.4 C1=CC=C2C(=C1)NC(=N2)C3=NNC4=C3C=C(C=C4)NC(=O)NC5=C(C=C(C=C5)F)F IC50 ~ 100000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BEO7N5 N-[(2-Hydroxy-5-phenylphenyl)carbamothioyl]-3,5-dimethylbenzamide Investigative 56599286 C22H20N2O2S 376.5 CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=CC=CC=C3)O)C IC50 = 52300 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BI8D7B 3-(1H-Benzo[d]imidazol-2-yl)-5-(3-(trifluoromethyl)phenyl)-1H-indazole Investigative 136232550 C21H13F3N4 378.3 C1=CC=C2C(=C1)NC(=N2)C3=NNC4=C3C=C(C=C4)C5=CC(=CC=C5)C(F)(F)F IC50 = 55700 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BJL1T9 N-(4-Oxo-3H-thieno[3,2-d]pyrimidin-7-yl)benzamide Investigative 136244204 C13H9N3O2S 271.3 C1=CC=C(C=C1)C(=O)NC2=CSC3=C2N=CNC3=O IC50 = 95000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BJN90A 3,5-Diamino-[1,2,4]triazine-6-carboxylic acid amide Investigative 53317177 C4H6N6O 154.13 C1(=C(N=C(N=N1)N)N)C(=O)N IC50 = 145000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BJU4G2 4-[[3-[[2-(2-Hydroxyethylamino)pyridine-4-carbonyl]amino]phenyl]methylamino]quinazoline-8-carboxamide Investigative 68078828 C24H23N7O3 457.5 C1=CC(=CC(=C1)NC(=O)C2=CC(=NC=C2)NCCO)CNC3=NC=NC4=C3C=CC=C4C(=O)N IC50 = 96000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BJWN49 Thieno[3,2-d]pyrimidin-4(3H)-one, 7-(methylamino)- Investigative 136254212 C7H7N3OS 181.22 CNC1=CSC2=C1N=CNC2=O IC50 = 154000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BK2GQ1 N-Benzyl-N-methyl-4-(phenylsulfamoyl)benzamide Investigative 27666048 C21H20N2O3S 380.5 CN(CC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3 IC50 ~ 100000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BKJ27P N-[(2-Hydroxy-5-nitrophenyl)carbamothioyl]-3,5-dimethylbenzamide Investigative 4999938 C16H15N3O4S 345.4 CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)C IC50 = 80500 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BNM1P0 6-Methoxy-2-(1h-Pyrazol-5-Yl)-1h-Benzimidazole Investigative 135567140 C11H10N4O 214.22 COC1=CC2=C(C=C1)N=C(N2)C3=CC=NN3 IC50 = 93000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BOA45V Isoxanthohumol Investigative 513197 C21H22O5 354.4 CC(=CCC1=C2C(=C(C=C1O)OC)C(=O)CC(O2)C3=CC=C(C=C3)O)C IC50 = 58700 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BOTL81 6-(4-Methoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one Investigative 135421655 C13H10N2O2S 258.3 COC1=CC=C(C=C1)C2=CC3=C(S2)C(=O)NC=N3 IC50 = 86000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BOU37W 7-Chlorothieno[3,2-b]pyridin-5(4H)-one Investigative 12628603 C7H4ClNOS 185.63 C1=CSC2=C1NC(=O)C=C2Cl IC50 = 102000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BP9LU6 1,2,4-Benzotriazin-3-amine Investigative 88336 C7H6N4 146.15 C1=CC=C2C(=C1)N=C(N=N2)N IC50 = 160000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BRN8J1 N-[3-(2-Pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-3-(trifluoromethyl)benzamide Investigative 24822704 C25H16F3N5O 459.4 C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C3=CC=NC4=CC(=NN34)C5=CC=NC=C5 IC50 ~ 50000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BT20NQ n-Methyl-1h-pyrazolo[3,4-d]pyrimidin-4-amine Investigative 221158 C6H7N5 149.15 CNC1=NC=NC2=C1C=NN2 IC50 = 90800 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BT7PH2 4-(1-(Carboxymethyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-ylthio)benzoic acid Investigative 49798541 C19H17NO5S 371.4 C1CC2=CC=CC=C2N(C(=O)C1SC3=CC=C(C=C3)C(=O)O)CC(=O)O EC50 = 187000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BTN04Z 4-[(2,3-Difluorophenyl)methylamino]quinazoline-8-carboxamide Investigative 66763022 C16H12F2N4O 314.29 C1=CC(=C(C(=C1)F)F)CNC2=NC=NC3=C2C=CC=C3C(=O)N IC50 = 87000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BTS27W 2-[3-(4-Iodophenyl)-3-oxo-1-phenylpropyl]propanedioic acid Investigative 45381792 C18H15IO5 438.2 C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)I)C(C(=O)O)C(=O)O EC50 = 60000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BV75OH 4-Bromo-3-chloro-1H-indazole Investigative 24729254 C7H4BrClN2 231.48 C1=CC2=NNC(=C2C(=C1)Br)Cl IC50 = 163600 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BVI90B Chembl4276946 Investigative 134611886 C12H11Cl2N3O 284.14 CC1=NN(C(=C1C2=CC(=C(C=C2)Cl)Cl)N)C(=O)C IC50 ~ 100000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BVW94C 5-[4-[5-Phenanthren-2-yl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]-2H-tetrazole Investigative 44181524 C25H15F3N6 456.4 C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)C4=CC(=NN4C5=CC=C(C=C5)C6=NNN=N6)C(F)(F)F IC50 = 52000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BWL79T 4-[[3-Methoxy-1-[3-[(4-methoxybenzoyl)amino]phenyl]propyl]amino]quinazoline-8-carboxamide Investigative 68079073 C27H27N5O4 485.5 COCCC(C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)OC)NC3=NC=NC4=C3C=CC=C4C(=O)N IC50 = 96000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BX5B7L 1-(3-(1H-Benzo[d]imidazol-2-yl)-1H-indazol-5-yl)-3-cyclopentylurea Investigative 136232554 C20H20N6O 360.4 C1CCC(C1)NC(=O)NC2=CC3=C(C=C2)NN=C3C4=NC5=CC=CC=C5N4 IC50 = 53900 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BXW75M 1H-Indole-7-carboxamide Investigative 13415516 C9H8N2O 160.17 C1=CC2=C(C(=C1)C(=O)N)NC=C2 IC50 = 97500 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BYD40F 4-[1-[3-[[4-(Trifluoromethoxy)benzoyl]amino]phenyl]propylamino]quinazoline-8-carboxamide Investigative 68078922 C26H22F3N5O3 509.5 CCC(C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)OC(F)(F)F)NC3=NC=NC4=C3C=CC=C4C(=O)N IC50 = 77000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 BZL29O (S)-((R)-Tetralin-1-ylmethylamino)(4-fluorophenyl)methylphosphonic acid Investigative 25628008 C18H21FNO3P 349.3 C1C[C@H](C2=CC=CC=C2C1)CN[C@H](C3=CC=C(C=C3)F)P(=O)(O)O EC50 = 50000 nM Poor binder T20891 Phosphoinositide dependent protein kinase-1 D0S3TJ 6-MORPHOLIN-4-YL-9H-PURINE Investigative 76098 C9H11N5O 205.22 C1COCCN1C2=NC=NC3=C2NC=N3 IC50 = 92000 nM Poor binder