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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02703177

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
L224-(2-amino-1,3-thiazol-4-yl)pyrimidin-
2-amine
A,B2W700.82
TPSTHIAMIN PHOSPHATEA,B3C9T0.72
TPSTHIAMIN PHOSPHATEA2HOM0.72
TPSTHIAMIN PHOSPHATEA,B1G4S0.72
TPSTHIAMIN PHOSPHATEA,B,C,D2QRY0.72
TPSTHIAMIN PHOSPHATEA,B2TPS0.72
CK24-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)PYRIMIDIN-
2-AMINE
A,C2C5O0.81
CK24-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)PYRIMIDIN-
2-AMINE
A1PXJ0.81
CK8N-[4-(2,4-DIMETHYL-THIAZOL-5-YL)-
PYRIMIDIN-2-YL]-N',N'-DIMETHYL-
BENZENE-1,4-DIAMINE
A,C2C5N0.78
CK8N-[4-(2,4-DIMETHYL-THIAZOL-5-YL)-
PYRIMIDIN-2-YL]-N',N'-DIMETHYL-
BENZENE-1,4-DIAMINE
A1PXP0.78
CK7[4-(2-AMINO-4-METHYL-THIAZOL-5-
YL)-PYRIMIDIN-2-YL]-(3-NITRO-PHENYL)-
AMINE
A1PXO0.76
CK7[4-(2-AMINO-4-METHYL-THIAZOL-5-
YL)-PYRIMIDIN-2-YL]-(3-NITRO-PHENYL)-
AMINE
A,C2C5P0.76
FTP3-(4-AMINO-2-TRIFLUOROMETHYL-PYRIMIDIN-
5-YLMETHYL)-4-METHYL-5-(2-PHOSPHONATOOXY-
ETHYL)-THIAZOL-3-IUM
A,B1G4T0.71
CK3N-[4-(2,4-DIMETHYL-1,3-THIAZOL-
5-YL)PYRIMIDIN-2-YL]-N'-HYDROXYIMIDOFORMAMIDE
A1PXK0.79
VIB3-(4-AMINO-2-METHYL-PYRIMIDIN-5-
YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-
METHYL-THIAZOL-3-IUM
A,B2HH90.74
VIB3-(4-AMINO-2-METHYL-PYRIMIDIN-5-
YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-
METHYL-THIAZOL-3-IUM
A,B1SBR0.74
VIB3-(4-AMINO-2-METHYL-PYRIMIDIN-5-
YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-
METHYL-THIAZOL-3-IUM
A,B1IG00.74
VIB3-(4-AMINO-2-METHYL-PYRIMIDIN-5-
YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-
METHYL-THIAZOL-3-IUM
A,B1IG30.74
TDPTHIAMIN DIPHOSPHATEA,B,C,D,E,F2PAN0.71
TDPTHIAMIN DIPHOSPHATEA,B1OLX0.71
TDPTHIAMIN DIPHOSPHATEA,B1X7Z0.71
TDPTHIAMIN DIPHOSPHATEA,B1V110.71
TDPTHIAMIN DIPHOSPHATEA,B2BFB0.71
TDPTHIAMIN DIPHOSPHATEA,B1PYD0.71
TDPTHIAMIN DIPHOSPHATEA,B1OLS0.71
TDPTHIAMIN DIPHOSPHATEA,B1OLU0.71
TDPTHIAMIN DIPHOSPHATEA,B1V1M0.71
TDPTHIAMIN DIPHOSPHATEA,B1X7W0.71
TDPTHIAMIN DIPHOSPHATEA,B,C,D2O1X0.71
TDPTHIAMIN DIPHOSPHATEA,B2QTA0.71
TDPTHIAMIN DIPHOSPHATEA,C,E,G1W880.71
TDPTHIAMIN DIPHOSPHATEA2FWN0.71
TDPTHIAMIN DIPHOSPHATEA,B3EY90.71
TDPTHIAMIN DIPHOSPHATEA,B,C,D2O1S0.71
TDPTHIAMIN DIPHOSPHATEA,B1DTW0.71
TDPTHIAMIN DIPHOSPHATEA,B1X7Y0.71
TDPTHIAMIN DIPHOSPHATEA,B1X7X0.71
TDPTHIAMIN DIPHOSPHATEA,B1U5B0.71
TDPTHIAMIN DIPHOSPHATEA,C1UMD0.71
TDPTHIAMIN DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1MCZ0.71
TDPTHIAMIN DIPHOSPHATEA,B2BFE0.71
TDPTHIAMIN DIPHOSPHATEA,C,D1UMC0.71
TDPTHIAMIN DIPHOSPHATEA,B,C,D,E,F,
G,H
1W850.71
TDPTHIAMIN DIPHOSPHATEA,B1X800.71
TDPTHIAMIN DIPHOSPHATEA,C1UMB0.71
TDPTHIAMIN DIPHOSPHATEA,B1V160.71
TDPTHIAMIN DIPHOSPHATEA,B1QS00.71
TDPTHIAMIN DIPHOSPHATEA,B1L8A0.71
TDPTHIAMIN DIPHOSPHATEA,B2BFD0.71
TDPTHIAMIN DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
3EYA0.71
TDPTHIAMIN DIPHOSPHATEA,B2IEA0.71
CK44-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)-
N-[4-(TRIFLUOROMETHYL)PHENYL]PYRIMIDIN-
2-AMINE
A1PXL0.74
CK44-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)-
N-[4-(TRIFLUOROMETHYL)PHENYL]PYRIMIDIN-
2-AMINE
A,C,F,H2C5V0.74
VNP3-[(4-AMINO-2-METHYLPYRIMIDIN-5-
YL)METHYL]-5-(2-{[HYDROXY(PHOSPHONOAMINO)PHOSPHORYL]OXY}ETHYL)-
4-METHYL-1,3-THIAZOL-3-IUM
A,B2G9Z0.71
TPPTHIAMINE DIPHOSPHATEA2HOK0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2VK80.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2AG10.71
TPPTHIAMINE DIPHOSPHATEA,B2PDA0.71
TPPTHIAMINE DIPHOSPHATEA,B1JSC0.71
TPPTHIAMINE DIPHOSPHATEA1BFD0.71
TPPTHIAMINE DIPHOSPHATEA,B2C3M0.71
TPPTHIAMINE DIPHOSPHATEA1Z8N0.71
TPPTHIAMINE DIPHOSPHATEA,B2JLC0.71
TPPTHIAMINE DIPHOSPHATEA,B2C3O0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2VK40.71
TPPTHIAMINE DIPHOSPHATEA3E780.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2OZL0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D,E,F,
G,H
3EXF0.71
TPPTHIAMINE DIPHOSPHATEA,B1NGS0.71
TPPTHIAMINE DIPHOSPHATEA,B2Q270.71
TPPTHIAMINE DIPHOSPHATEA,B1POX0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2IHV0.71
TPPTHIAMINE DIPHOSPHATEA,B,C1ITZ0.71
TPPTHIAMINE DIPHOSPHATEA,B1N0H0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2IHT0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2VK10.71
TPPTHIAMINE DIPHOSPHATEA2HOL0.71
TPPTHIAMINE DIPHOSPHATEB2VBF0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D,E,F,
G,H
3EXE0.71
TPPTHIAMINE DIPHOSPHATEA,B2Q280.71
TPPTHIAMINE DIPHOSPHATEA,B1QPB0.71
TPPTHIAMINE DIPHOSPHATEA2HOJ0.71
TPPTHIAMINE DIPHOSPHATEA,B2Q290.71
TPPTHIAMINE DIPHOSPHATEA,B1R9J0.71
TPPTHIAMINE DIPHOSPHATEA,B3C9U0.71
TPPTHIAMINE DIPHOSPHATEA,B1B0P0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D1UPA0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D,E,F,
G,H
2VBI0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D1NI40.71
TPPTHIAMINE DIPHOSPHATEA3E790.71
TPPTHIAMINE DIPHOSPHATEA,B3D2G0.71
TPPTHIAMINE DIPHOSPHATEA,B2JI80.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D1UPB0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2JLA0.71
TPPTHIAMINE DIPHOSPHATEA,B2PGO0.71
TPPTHIAMINE DIPHOSPHATEA,B1POW0.71
TPPTHIAMINE DIPHOSPHATEA,B2CKY0.71
TPPTHIAMINE DIPHOSPHATEA3EKI0.71
TPPTHIAMINE DIPHOSPHATEA,B2PGN0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2VJY0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2UZ10.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2W930.71
TPPTHIAMINE DIPHOSPHATEA,B1QGD0.71
TPPTHIAMINE DIPHOSPHATEA,B2EZ40.71
TPPTHIAMINE DIPHOSPHATEA,B2JIB0.71
TPPTHIAMINE DIPHOSPHATEA,B1AY00.71
TPPTHIAMINE DIPHOSPHATEA1V5F0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D1Y9D0.71
TPPTHIAMINE DIPHOSPHATEA,B1OZF0.71
TPPTHIAMINE DIPHOSPHATEA,B2C420.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D,E,F1UPC0.71
TPPTHIAMINE DIPHOSPHATEA,B2R5N0.71
TPPTHIAMINE DIPHOSPHATEA,B1TRK0.71
TPPTHIAMINE DIPHOSPHATEA,B2NXW0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2V3W0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D1OVM0.71
TPPTHIAMINE DIPHOSPHATEX,Y2GDI0.71
TPPTHIAMINE DIPHOSPHATEA,B,C,D2AG00.71
TPPTHIAMINE DIPHOSPHATEA,C,E,G3EXH0.71
TPPTHIAMINE DIPHOSPHATEA,B1PVD0.71