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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03080667

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PYD2,5-DIMETHYL-PYRIMIDIN-4-YLAMINEA4THI0.72
MP5(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL DIHYDROGEN PHOSPHATEA,B3EPO0.7
MP5(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL DIHYDROGEN PHOSPHATEA,B,C,D1RTW0.7
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B1JXI0.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B1TO90.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B2Q4X0.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B3EPM0.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B,C,D1YAK0.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B,C,D2GM80.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B2F2G0.71
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
A,B1T9B0.72
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
I1E800.72
YF45-{[ETHYL(METHYL)AMINO]METHYL}-
2-METHYL-5,6-DIHYDROPYRIMIDIN-4-
AMINE
A,B1T9A0.75
YF32-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}PROPANE-1-THIOL
A,B1T9A0.73
YF32-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}PROPANE-1-THIOL
A,B1T9B0.73
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,B1RP70.71
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A1PO70.71
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A2FN30.71
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,B2BFF0.71
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,B2C310.71
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,B2BFC0.71
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A1Q6Z0.71
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A1PI30.71
TZD2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]-4-METHYL-2-OXO-2,3-
DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
A1YNO0.71
1TP1-(2-{(2S,4R,5R)-3-[(4-AMINO-2-
METHYLPYRIMIDIN-5-YL)METHYL]-2-
[(1S)-1-CARBOXY-1-HYDROXYETHYL]-
4-METHYL-1,3-THIAZOLIDIN-5-YL}ETHOXY)-
1,1,3,3-TETRAHYDROXY-1LAMBDA~5~-
DIPHOSPHOX-1-EN-2-IUM 3-OXIDE
A,B2C3P0.73
PF1N-[(4-AMINO-2-METHYLPYRIMIDIN-5-
YL)METHYL]-N-(2-HYDROXYETHYL)FORMAMIDE
A,B2QCX0.8
YF12,5-DIMETHYLPYRIMIDIN-4-AMINEA,B,C,D1T9D0.72