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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813191

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
YF32-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}PROPANE-1-THIOL
A,B1T9A0.74
YF32-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}PROPANE-1-THIOL
A,B1T9B0.74
TDM2-[(2E)-3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-2-(1-HYDROXYETHYLIDENE)-
4-METHYL-2,3-DIHYDRO-1,3-THIAZOL-
5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE
A,B2EZT0.78
TDM2-[(2E)-3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-2-(1-HYDROXYETHYLIDENE)-
4-METHYL-2,3-DIHYDRO-1,3-THIAZOL-
5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE
A3E9Y0.78
TDM2-[(2E)-3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-2-(1-HYDROXYETHYLIDENE)-
4-METHYL-2,3-DIHYDRO-1,3-THIAZOL-
5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE
A3EA40.78
YF12,5-DIMETHYLPYRIMIDIN-4-AMINEA,B,C,D1T9D0.83
MP5(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL DIHYDROGEN PHOSPHATEA,B3EPO1
MP5(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL DIHYDROGEN PHOSPHATEA,B,C,D1RTW1
LGAPYRIMIDIN-2-AMINEA2JJC0.71
DPXMONO-{4-[(4-AMINO-2-METHYL-PYRIMIDIN-
5-YLMETHYL)-AMINO]-2-HYDROXY-3-
MERCAPTO-PENT-3-ENYL-PHOSPHONO} ESTER
A,B,E,F1ZPD0.77
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A,B1RP70.76
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A1PO70.76
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A2FN30.76
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A,B2BFF0.76
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A,B2C310.76
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A,B2BFC0.76
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A1Q6Z0.76
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A1PI30.76
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A1YNO0.76
THD2-[3-[(4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL]-
2-(1,2-DIHYDROXYETHYL)-4-METHYL-
1,3-THIAZOL-3-IUM-5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE
A,B1GPU0.76
YF45-{[ETHYL(METHYL)AMINO]METHYL}-
2-METHYL-5,6-DIHYDROPYRIMIDIN-4-
AMINE
A,B1T9A0.8
AYDA,B1N0H0.83
TP9(3Z)-4-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}-3-MERCAPTOPENT-
3-EN-1-YL TRIHYDROGEN DIPHOSPHATE
A,B,C,D2IHU0.82
LG3PYRIMIDINE-2,4-DIAMINEA2EUN0.71
FQP4-AMINO-2-TRIFLUOROMETHYL-5-HYDROXYMETHYLPYRIMIDINE PYROPHOSPHATEA,B1G4P0.94
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B1JXI0.89
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B1TO90.89
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B2Q4X0.89
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B3EPM0.89
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B,C,D1YAK0.89
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B,C,D2GM80.89
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B2F2G0.89
PYD2,5-DIMETHYL-PYRIMIDIN-4-YLAMINEA4THI0.83
PF1N-[(4-AMINO-2-METHYLPYRIMIDIN-5-
YL)METHYL]-N-(2-HYDROXYETHYL)FORMAMIDE
A,B2QCX0.81
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
A,B1T9B0.82
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
I1E800.82