BindingDB logo
myBDB logout

79 SMILES Strings for Isoleucyl-tRNA synthetase

Compound NameSMILES String
BDBM50075055 CC(C)C[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(CCc2ccc(Oc3ccccc3)cc2)cs1
BDBM50075056 CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(CCc2ccccc2)cs1
BDBM50075057 N[C@@H](Cc1cnc[nH]1)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccccc1
BDBM50075058 CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1cccc(OC)c1
BDBM50075059 CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccccc1OC
BDBM50075060 N[C@@H](Cc1ccccc1)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccccc1
BDBM50075061 CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccc2cc(OC)ccc2c1
BDBM50075062 CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1cc(co1)C#N
BDBM50075063 CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccc(OC)cc1
BDBM50075064 CC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccccc1
BDBM50075065 CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(CCc2ccc(Oc3ccccc3)cc2)cs1
BDBM50075066 C[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccccc1
BDBM50075067 CC(C)C[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccc(Oc2ccccc2)cc1
BDBM50075068 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccccc1
BDBM50075069 CC(C)C[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(CCc2ccccc2)cs1
BDBM50075070 CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)c1nc(cs1)-c1ccc(Oc2ccccc2)cc1
BDBM50093001 CC(C)[C@H](N)C(=O)NS(=O)(=O)CC(=O)N[C@]1([C@@H](O)C[C@@H]2[C@H]1CN(C)C=C2C(N)=O)C(O)=O |c:25|
BDBM50093002 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)CC(=O)N[C@]1([C@@H](O)C[C@@H]2[C@H]1CN(C)C=C2C(N)=O)C(=O)OCc1ccccc1 |c:26|
BDBM50093003 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)CC(=O)N[C@]1([C@@H](O)C[C@@H]2[C@H]1CN(C)C=C2C(N)=O)C(O)=O |c:26|
BDBM50093004 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)CC(=O)N[C@]1([C@@H](O)C[C@@H]2[C@H]1CN(C)C=C2C(N)=O)C(=O)OC |c:26|
BDBM50093005 CC(C)C[C@H](N)C(=O)NS(=O)(=O)CC(=O)N[C@]1([C@@H](O)C[C@@H]2[C@H]1CN(C)C=C2C(N)=O)C(O)=O |c:26|
BDBM50093006 CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NS(=O)(=O)CC(=O)N[C@]1([C@H](C[C@@H]2[C@H]1CN(C)C=C2C(N)=O)OC(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC)C(=O)OC |c:36|
BDBM50093007 CC[C@H](C)CC(=O)NS(=O)(=O)CC(=O)N[C@]1([C@H](C[C@@H]2[C@H]1CN(C)C=C2C(N)=O)OC(=O)C[C@@H](C)CC)C(O)=O |c:24|
BDBM50093008 CC[C@H](C)CC(=O)NS(=O)(=O)CC(=O)N[C@]1([C@@H](O)C[C@@H]2[C@H]1CN(C)C=C2C(N)=O)C(O)=O |c:25|
BDBM50099071 CC[C@H](C)[C@H]([NH3+])C(=O)N(O)C[C@H]1O[C@@H](CCn2nnc(n2)-c2ccccc2)[C@H](O)[C@@H]1O
BDBM50099072 CC[C@H](C)[C@H]([NH3+])C(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
BDBM50099073 CC[C@H](C)[C@H]([NH3+])C(=O)N(O)C[C@H]1O[C@@H](CCn2cnc3c(N)ncnc23)[C@H](O)[C@@H]1O
BDBM50099074 CC[C@H](C)[C@H]([NH3+])C(=O)OC[C@H]1O[C@@H](Cn2cnc3c(N)ncnc23)[C@H](O)[C@@H]1O
BDBM50099075 CC[C@H](C)[C@H]([NH3+])C(=O)N(O)C[C@H]1O[C@@H](Cn2cnc3c(N)ncnc23)[C@H](O)[C@@H]1O
BDBM50099077 CC[C@H](C)[C@H]([NH3+])C(=O)OC[C@H]1O[C@@H](CCn2nnc(n2)-c2ccccc2)[C@H](O)[C@@H]1O
BDBM50099078 CC[C@H](C)[C@H]([NH3+])C(=O)N(O)C[C@H]1O[C@@H](CCn2cnc3c(NCc4ccccc4)ncnc23)[C@H](O)[C@@H]1O
BDBM50099081 CC[C@H](C)[C@H]([NH3+])C(=O)OC[C@H]1O[C@@H](CCn2cnc3c(N)ncnc23)[C@H](O)[C@@H]1O
BDBM50099082 CC[C@H](C)[C@H]([NH3+])C(=O)OC[C@H]1O[C@@H](CCn2cnc3c(NCc4ccccc4)ncnc23)[C@H](O)[C@@H]1O
BDBM50099091 CC[C@H](C)[C@H]([NH3+])C(=O)N(O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
BDBM50099092 CCC(C)[C@H]([NH3+])C(=O)OC[C@H]1COC(=N1)c1ccc(O)c(OC)c1 |c:13|
BDBM50099094 CCC(C)[C@H]([NH3+])C(=O)OCCN(O)C(=O)c1ccc(O)c(OC)c1
BDBM50099095 CCC(C)[C@H]([NH3+])C(=O)OCCNC(=O)Cc1ccc(O)c(OC)c1
BDBM50099097 CCC(C)[C@H]([NH3+])C(=O)OCC1CC(=NO1)c1ccc(O)c(OC)c1 |c:12|
BDBM50099098 CCC(C)[C@H]([NH3+])C(=O)OCCNC(=O)c1ccc(OC)c(O)c1
BDBM50099099 CCC(C)[C@H]([NH3+])C(=O)OC[C@@H]1COC(=N1)c1ccc(O)c(OC)c1 |c:13|
BDBM50099100 CCC(C)[C@H]([NH3+])C(=O)OCCN(O)C(=O)Cc1ccc(OC)c(O)c1
BDBM50099101 CCC(C)[C@H]([NH3+])C(=O)OCCN(O)C(=O)c1ccc(OC)c(O)c1
BDBM50099105 CCC(C)[C@H]([NH3+])C(=O)OCC1CC(=NO1)c1ccc(OC)c(O)c1 |c:12|
BDBM50099109 CCC(C)[C@H]([NH3+])C(=O)OCCNC(=O)Cc1ccc(OC)c(O)c1
BDBM50099112 CCC(C)[C@H]([NH3+])C(=O)OCCN(O)C(=O)Cc1ccc(O)c(OC)c1
BDBM50099114 CCC(C)[C@H]([NH3+])C(=O)OCCNC(=O)c1ccc(O)c(OC)c1
BDBM50290684 COC(=O)CCCCCCCCOC(=O)\C=C\C[C@@H]1OC[C@H](NS(C)(=O)=O)[C@@H](O)[C@H]1O
BDBM50290685 CCCS(=O)(=O)N[C@H]1CO[C@@H](C\C=C\C(=O)OCCCCCCCCC(=O)OC)[C@H](O)[C@@H]1O
BDBM50290686 C[C@H](O)[C@H](C)[C@@H]1O[C@H]1C[C@H]1CO[C@@H](C\C(C)=C\C(=O)OCCCCCCCCC(O)=O)[C@H](O)[C@@H]1O |r|
BDBM50290687 CCCCS(=O)(=O)N[C@H]1CO[C@@H](C\C=C\C(=O)OCCCCCCCCC(=O)OC)[C@H](O)[C@@H]1O
BDBM50290688 COC(=O)CCCCCCCCOC(=O)\C=C\C[C@@H]1OC[C@H](NS(=O)(=O)c2cccc(Cl)c2)[C@@H](O)[C@H]1O
BDBM50290689 COC(=O)CCCCCCCCOC(=O)\C=C\C[C@@H]1OC[C@H](NS(=O)(=O)CCCCl)[C@@H](O)[C@H]1O
BDBM50366859 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(NC)nc(I)nc12 |r|
BDBM50366862 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)nc(nc12)C#C |r|
BDBM50366865 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)NOC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
BDBM50366870 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)nc(I)nc12 |r|
BDBM50366871 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)nc(Cl)nc12 |r|
BDBM50366872 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)N(O)C[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
BDBM50366874 CCCCC#Cc1nc(N)c2ncn(C3O[C@H](COS(=O)(=O)NC(=O)[C@@H](N)[C@@H](C)CC)[C@@H](O)[C@H]3O)c2n1 |r|
BDBM50217933 [H][C@]1(C\C=C(/C)\C=C\[C@H](O[SiH2]C(C)(C)C)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(O)=O)[C@@]([H])(O2)\C=C\C(\C)=C\C(O)=O
BDBM50217845 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(=O)OC)[C@@]([H])(O2)\C=C\C=C\C(=O)OC
BDBM50217847 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@@]2(CC[C@@](CCCC)(O2)[C@@H](O)\C=C\C(\C)=C\C(O)=O)CC[C@@H]1C
BDBM50217848 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OCSC)[C@@]([H])(O2)\C=C\C(\C)=C\C(=O)OC
BDBM50217849 [H][C@]1(C\C=C(/C)\C=C\[C@H](OC)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(O)=O)[C@@]([H])(O2)\C=C\C(\C)=C\C(O)=O |r|
BDBM50217932 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(=O)OC)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(=O)OC)[C@@]([H])(O2)\C=C\C(\C)=C\C(O)=O
BDBM50217934 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(=O)OC)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(O)=O)[C@@]([H])(O2)\C=C\C=C\C(O)=O
BDBM50217935 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC)[C@@]([H])(O2)\C=C\C(\C)=C\C(O)=O |r|
BDBM50217936 [H][C@]1(CCC(C)CC[C@H](O)[C@@H](C)CCC(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(O)=O)[C@]([H])(CCC(C)CC(O)=O)O2
BDBM50217937 [H][C@]1(C\C=C(/C)\C=C\[C@H](OC(C)=O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(O)=O)[C@@]([H])(O2)\C=C\C(\C)=C\C(O)=O |r|
BDBM50217938 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(=O)OC)[C@@]([H])(O2)\C=C\C=C\C(O)=O
BDBM50217838 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@@]2(CC[C@@](CCCC)(O2)[C@@H](OC)\C=C\C(\C)=C\C(O)=O)CC[C@@H]1C
BDBM50217843 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(=O)OC)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(O)=O)[C@@]([H])(O2)\C=C\C=C\C(=O)OC
BDBM50217846 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(O)=O)[C@@]([H])(O2)\C=C\C=C\C(=O)OC
BDBM50217839 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OCSC)[C@@]([H])(O2)\C=C\C(\C)=C\C(O)=O |r|
BDBM50217840 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(=O)OC)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(=O)OC)[C@@]([H])(O2)\C=C\C(\C)=C\C(=O)OC
BDBM50217841 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@@](CCCC)(OC(=O)CCC(O)=O)[C@@]([H])(O2)\C=C\C(\C)=C\C(O)=O |r|
BDBM50217842 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@@]2(CC[C@@](CCCC)(O2)[C@@H](OC(=O)CCC(O)=O)\C=C\C(\C)=C\C(O)=O)CC[C@@H]1C |r|
BDBM50217844 [H][C@]1(C\C=C(/C)\C=C\[C@H](O)[C@@H](C)\C=C\C(O)=O)O[C@]2(CC[C@@H]1C)CC[C@](O)(CCCC)[C@@]([H])(O2)\C=C\C(\C)=C\C(O)=O |r|
BDBM50222902 CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|