TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T38284 Fusion protein Bcr-Abl B3EX0U N-[2-[[4-(3-Amino-1H-indazol-4-yl)benzoyl]amino]ethyl]-2-methoxybenzamide Investigative 122196202 C24H23N5O3 429.5 COC1=CC=CC=C1C(=O)NCCNC(=O)C2=CC=C(C=C2)C3=C4C(=CC=C3)NN=C4N IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl B3U1ZK [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]methanone Investigative 122196189 C27H27N5O4 485.5 COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=C5C(=CC=C4)NN=C5N)OC IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl B3VU6W N-[2-[[4-(3-Amino-1H-indazol-4-yl)benzoyl]amino]ethyl]-3-(trifluoromethyl)benzamide Investigative 122196200 C24H20F3N5O2 467.4 C1=CC(=CC(=C1)C(F)(F)F)C(=O)NCCNC(=O)C2=CC=C(C=C2)C3=C4C(=CC=C3)NN=C4N IC50 = 56270 nM Poor binder T38284 Fusion protein Bcr-Abl B3ZLF2 4-(4-Methylphenyl)-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]pyrimidin-2-amine Investigative 73351906 C19H15F4N3O 377.3 CC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)OC(C(F)F)(F)F IC50 = 50118.72 nM Poor binder T38284 Fusion protein Bcr-Abl B4W5EY [4-(2-Fluorobenzoyl)piperazin-1-yl]-[4-[6-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]phenyl]methanone Investigative 118722069 C29H23F4N5O2 549.5 C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=CC(=NC=N3)NC4=CC=C(C=C4)C(F)(F)F)C(=O)C5=CC=CC=C5F IC50 = 78600 nM Poor binder T38284 Fusion protein Bcr-Abl B68CGO [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-(2-methoxybenzoyl)piperazin-1-yl]methanone Investigative 122196195 C26H25N5O3 455.5 COC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=C5C(=CC=C4)NN=C5N IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl B6J9NQ 4-Pyridin-4-yl-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]pyrimidin-2-amine Investigative 9799152 C17H12F4N4O 364.3 C1=CC(=CC(=C1)OC(C(F)F)(F)F)NC2=NC=CC(=N2)C3=CC=NC=C3 IC50 = 100000 nM Poor binder T38284 Fusion protein Bcr-Abl B6N9JD [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-(2-methylbenzoyl)piperazin-1-yl]methanone Investigative 122196196 C26H25N5O2 439.5 CC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=C5C(=CC=C4)NN=C5N IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl B6QWJ4 [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-(4-methoxybenzoyl)piperazin-1-yl]methanone Investigative 122196192 C26H25N5O3 455.5 COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=C5C(=CC=C4)NN=C5N IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl B87MSV [4-[6-(3-Chloroanilino)pyrimidin-4-yl]phenyl]-[4-(2-fluorobenzoyl)piperazin-1-yl]methanone Investigative 118722086 C28H23ClFN5O2 516 C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=CC(=NC=N3)NC4=CC(=CC=C4)Cl)C(=O)C5=CC=CC=C5F IC50 = 91800 nM Poor binder T38284 Fusion protein Bcr-Abl B8SO6Y N-[2-[[4-(3-Amino-1H-indazol-4-yl)benzoyl]amino]ethyl]-3-fluorobenzamide Investigative 122196201 C23H20FN5O2 417.4 C1=CC(=CC(=C1)F)C(=O)NCCNC(=O)C2=CC=C(C=C2)C3=C4C(=CC=C3)NN=C4N IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl B9VF8A [4-[6-(2-Chloroanilino)pyrimidin-4-yl]phenyl]-[4-(2-fluorobenzoyl)piperazin-1-yl]methanone Investigative 118722074 C28H23ClFN5O2 516 C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=CC(=NC=N3)NC4=CC=CC=C4Cl)C(=O)C5=CC=CC=C5F IC50 = 141000 nM Poor binder T38284 Fusion protein Bcr-Abl BACZ82 [4-[3-(Dimethylamino)benzoyl]piperazin-1-yl]-[4-[6-(4-methoxyanilino)pyrimidin-4-yl]phenyl]methanone Investigative 122190873 C31H32N6O3 536.6 CN(C)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC(=NC=N4)NC5=CC=C(C=C5)OC IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BBG64C [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-(3-methylbenzoyl)piperazin-1-yl]methanone Investigative 122196193 C26H25N5O2 439.5 CC1=CC(=CC=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=C5C(=CC=C4)NN=C5N IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BBG8S9 [4-[6-(4-Methoxyanilino)pyrimidin-4-yl]phenyl]-[4-(4-methoxybenzoyl)piperazin-1-yl]methanone Investigative 122190867 C30H29N5O4 523.6 COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC(=NC=N4)NC5=CC=C(C=C5)OC IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BD0AT7 N-[2-[[4-(3-Amino-1H-indazol-4-yl)benzoyl]amino]ethyl]-3,4-difluorobenzamide Investigative 122196197 C23H19F2N5O2 435.4 C1=CC(=C2C(=C1)NN=C2N)C3=CC=C(C=C3)C(=O)NCCNC(=O)C4=CC(=C(C=C4)F)F IC50 = 75290 nM Poor binder T38284 Fusion protein Bcr-Abl BD1H6M [4-(3-Fluorobenzoyl)piperazin-1-yl]-[4-(4-methylpyridin-2-yl)phenyl]methanone Investigative 122189051 C24H22FN3O2 403.4 CC1=CC(=NC=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F IC50 = 63300 nM Poor binder T38284 Fusion protein Bcr-Abl BDBZ42 [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]methanone Investigative 122196190 C26H22F3N5O2 493.5 C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=C4C(=CC=C3)NN=C4N)C(=O)C5=CC(=CC=C5)C(F)(F)F IC50 = 94570 nM Poor binder T38284 Fusion protein Bcr-Abl BEM42G 4-Amino-N-(4-methyl-3-(4-(pyridin-3-yl)pyrimidin-2-ylamino)phenyl)benzamide Investigative 44340726 C23H20N6O 396.4 CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)N)NC3=NC=CC(=N3)C4=CN=CC=C4 IC50 = 67608.3 nM Poor binder T38284 Fusion protein Bcr-Abl BI8BX3 [4-(3-Methoxybenzoyl)piperazin-1-yl]-(4-thiophen-2-ylphenyl)methanone Investigative 122189060 C23H22N2O3S 406.5 COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=CS4 IC50 = 89700 nM Poor binder T38284 Fusion protein Bcr-Abl BIH86Z 5-Bromo-2-chloro-4-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]pyrimidine Investigative 134131688 C14H13BrClFN4O2S 435.7 C1CN(CCN1C2=NC(=NC=C2Br)Cl)S(=O)(=O)C3=CC=C(C=C3)F IC50 = 122000 nM Poor binder T38284 Fusion protein Bcr-Abl BJ7TS8 [4-[6-(4-Methoxyanilino)pyrimidin-4-yl]phenyl]-[4-(3-methylbenzoyl)piperazin-1-yl]methanone Investigative 122190872 C30H29N5O3 507.6 CC1=CC(=CC=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC(=NC=N4)NC5=CC=C(C=C5)OC IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BMI10Z (E)-3,5-Di-tert-butyl-3',5'-dimethoxystilbene-4-ol Investigative 11199480 C24H32O3 368.5 CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C2=CC(=CC(=C2)OC)OC IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BN0PL2 [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-(3-methoxybenzoyl)piperazin-1-yl]methanone Investigative 122196085 C26H25N5O3 455.5 COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=C5C(=CC=C4)NN=C5N IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BN0Z6P [4-[6-(4-Methoxyanilino)pyrimidin-4-yl]phenyl]-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]methanone Investigative 122190871 C30H26F3N5O3 561.6 COC1=CC=C(C=C1)NC2=NC=NC(=C2)C3=CC=C(C=C3)C(=O)N4CCN(CC4)C(=O)C5=CC(=CC=C5)C(F)(F)F IC50 = 51920 nM Poor binder T38284 Fusion protein Bcr-Abl BN56BV 2-(3,5-Dimethoxy-phenyl)-6-methoxy-naphthalene Investigative 11687939 C19H18O3 294.3 COC1=CC2=C(C=C1)C=C(C=C2)C3=CC(=CC(=C3)OC)OC IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BN58LP N-[2-[(4-Tert-butylbenzoyl)amino]ethyl]-4-[6-(4-methoxyanilino)pyrimidin-4-yl]benzamide Investigative 122190823 C31H33N5O3 523.6 CC(C)(C)C1=CC=C(C=C1)C(=O)NCCNC(=O)C2=CC=C(C=C2)C3=CC(=NC=N3)NC4=CC=C(C=C4)OC IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BP0HD2 [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-(4-chlorobenzoyl)piperazin-1-yl]methanone Investigative 122196194 C25H22ClN5O2 459.9 C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=C4C(=CC=C3)NN=C4N)C(=O)C5=CC=C(C=C5)Cl IC50 = 65630 nM Poor binder T38284 Fusion protein Bcr-Abl BQ40PL 1,3-Dimethoxy-5-[4-(4-methoxyphenyl)phenyl]benzene Investigative 11709536 C21H20O3 320.4 COC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=CC(=C3)OC)OC IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BR4X5J (3-Nitro-phenyl)-(4-pyridin-4-yl-pyrimidin-2-yl)-amine Investigative 9814609 C15H11N5O2 293.28 C1=CC(=CC(=C1)[N+](=O)[O-])NC2=NC=CC(=N2)C3=CC=NC=C3 IC50 = 61659.5 nM Poor binder T38284 Fusion protein Bcr-Abl BT4J7L 4-(3-Amino-1H-indazol-4-yl)-N-[2-[(4-methoxybenzoyl)amino]ethyl]benzamide Investigative 122196203 C24H23N5O3 429.5 COC1=CC=C(C=C1)C(=O)NCCNC(=O)C2=CC=C(C=C2)C3=C4C(=CC=C3)NN=C4N IC50 ~ 100000 nM Poor binder T38284 Fusion protein Bcr-Abl BU1QG7 [4-(3-Amino-1H-indazol-4-yl)phenyl]-[4-(3,4-difluorobenzoyl)piperazin-1-yl]methanone Investigative 122196191 C25H21F2N5O2 461.5 C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=C4C(=CC=C3)NN=C4N)C(=O)C5=CC(=C(C=C5)F)F IC50 = 83520 nM Poor binder T38284 Fusion protein Bcr-Abl BVI2B4 [4-(3-Methoxybenzoyl)piperazin-1-yl]-(4-pyridin-3-ylphenyl)methanone Investigative 122189048 C24H23N3O3 401.5 COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CN=CC=C4 IC50 = 60670 nM Poor binder T38284 Fusion protein Bcr-Abl BX9CF3 5-Bromo-2-chloro-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine Investigative 134137546 C15H16BrClN4O2S 431.7 CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC=C3Br)Cl IC50 = 58000 nM Poor binder T38284 Fusion protein Bcr-Abl BZ50MI [4-(2-Chlorobenzoyl)piperazin-1-yl]-[4-[6-(4-methoxyanilino)pyrimidin-4-yl]phenyl]methanone Investigative 122190831 C29H26ClN5O3 528 COC1=CC=C(C=C1)NC2=NC=NC(=C2)C3=CC=C(C=C3)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5Cl IC50 = 73910 nM Poor binder