TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T81311 Endoplasmin B4A2PH 4-[8-(2,4-Dimethoxyphenyl)sulfanyl-6-imino-7H-purin-3-yl]butanenitrile Investigative 136934959 C17H18N6O2S 370.4 COC1=CC(=C(C=C1)SC2=NC3=C(N2)C(=N)N=CN3CCCC#N)OC IC50 ~ 100000 nM Poor binder T81311 Endoplasmin B6CTK0 4-[8-(3,5-Dimethylphenyl)sulfanyl-6-imino-7H-purin-3-yl]butanenitrile Investigative 136198649 C17H18N6S 338.4 CC1=CC(=CC(=C1)SC2=NC3=C(N2)C(=N)N=CN3CCCC#N)C IC50 ~ 100000 nM Poor binder T81311 Endoplasmin B6X2AB 4-[6-Imino-8-[2-(trifluoromethoxy)phenyl]sulfanyl-7H-purin-3-yl]butanenitrile Investigative 136934956 C16H13F3N6OS 394.4 C1=CC=C(C(=C1)OC(F)(F)F)SC2=NC3=C(N2)C(=N)N=CN3CCCC#N IC50 ~ 100000 nM Poor binder T81311 Endoplasmin BBD06T Nc1ncn(CCCC#N)c2nc(Sc3cc(Cl)cc(Cl)c3)nc12 Investigative 136198648 C15H12Cl2N6S 379.3 C1=C(C=C(C=C1Cl)Cl)SC2=NC3=C(N2)C(=N)N=CN3CCCC#N IC50 = 100000 nM Poor binder T81311 Endoplasmin BET27B 4-[8-[2-Chloro-5-(trifluoromethyl)phenyl]sulfanyl-6-imino-7H-purin-3-yl]butanenitrile Investigative 136198647 C16H12ClF3N6S 412.8 C1=CC(=C(C=C1C(F)(F)F)SC2=NC3=C(N2)C(=N)N=CN3CCCC#N)Cl IC50 ~ 100000 nM Poor binder T81311 Endoplasmin BEV51C 4-[6-Imino-8-(2-methoxyphenyl)sulfanyl-7H-purin-3-yl]butanenitrile Investigative 136934954 C16H16N6OS 340.4 COC1=CC=CC=C1SC2=NC3=C(N2)C(=N)N=CN3CCCC#N IC50 ~ 100000 nM Poor binder T81311 Endoplasmin BJ2BF8 4-[8-[2-(Hydroxymethyl)phenyl]sulfanyl-6-imino-7H-purin-3-yl]butanenitrile Investigative 136934955 C16H16N6OS 340.4 C1=CC=C(C(=C1)CO)SC2=NC3=C(N2)C(=N)N=CN3CCCC#N IC50 ~ 100000 nM Poor binder T81311 Endoplasmin BUR97Q 4-[8-(2,5-Dimethylphenyl)sulfanyl-6-imino-7H-purin-3-yl]butanenitrile Investigative 136934961 C17H18N6S 338.4 CC1=CC(=C(C=C1)C)SC2=NC3=C(N2)C(=N)N=CN3CCCC#N IC50 ~ 100000 nM Poor binder T81311 Endoplasmin BXB9L4 4-[8-(2-Chlorophenyl)sulfanyl-6-imino-7H-purin-3-yl]butanenitrile Investigative 136934953 C15H13ClN6S 344.8 C1=CC=C(C(=C1)SC2=NC3=C(N2)C(=N)N=CN3CCCC#N)Cl IC50 = 100000 nM Poor binder