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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02261675

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
368(1R)-2-{[AMINO(IMINO)METHYL]AMINO}-
1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2-
DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE
A1ZLR0.72
896N-ETHYL-N-ISOPROPYL-3-METHYL-5-
{[(2S)-2-(PYRIDIN-4-YLAMINO)PROPYL]OXY}BENZAMIDE
B,H2UUJ0.74
608N-(4-phenoxyphenyl)-2-[(pyridin-
4-ylmethyl)amino]nicotinamide
A,B2P2I0.71
2823-methoxypyridineX2RBZ0.71
3IP3-(BENZYLOXY)PYRIDIN-2-AMINEA1W7H0.72
NCNNICOTINATE MONONUCLEOTIDEA,B2QTN0.72
NCNNICOTINATE MONONUCLEOTIDEA1L4F0.72
NCNNICOTINATE MONONUCLEOTIDEA1L4L0.72
NCNNICOTINATE MONONUCLEOTIDEA,B,C,D1YUM0.72
NCNNICOTINATE MONONUCLEOTIDEA1L4M0.72
NCNNICOTINATE MONONUCLEOTIDEA,B,C,D,E,F1QPN0.72
NCNNICOTINATE MONONUCLEOTIDEA,B,C2B7Q0.72
NCNNICOTINATE MONONUCLEOTIDEA1L4K0.72
NCNNICOTINATE MONONUCLEOTIDEA1L4G0.72
NCNNICOTINATE MONONUCLEOTIDEA1YTK0.72
NCNNICOTINATE MONONUCLEOTIDEA1L4H0.72
NCNNICOTINATE MONONUCLEOTIDEA1L5O0.72
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA2QSZ0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA1TA80.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA1HYB0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA3BAA0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA3BA90.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B1NUP0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B1NUS0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B1Y1P0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B,C,D,E,F2GVG0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA3BA80.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA3BAB0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B3DZK0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B,C1GZU0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B2H3D0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B2G960.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA2QG60.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B1ISJ0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B3DZJ0.74
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B2HCT0.74
D2GN-METHYL(5-(PYRIDIN-3-YL)FURAN-
2-YL)METHANAMINE
A,B,C,D2FDV0.74
7213-butoxy-1-(2,2-diphosphonoethyl)pyridiniumA,B3DYH0.72
PXA2-AMINO-1,9-DICARBONYL-4,6-DIMETHYL-
10-DEHYDRO-3-OXO(8-AZA)PHENOXAZINE
A209D0.74
D3G(5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINEA,B,C,D2FDW0.74
3HM5-hydroxy-6-methylpyridine-3-carboxylic acidA,B3GMC0.73
D1GN,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN-
2-YL)METHANAMINE
A,B,C,D2FDU0.73
POS1-[[(4-PHENOXYPHENYL)SULFONYL]AMINO]-
3-[[N/N-(4-PYRIDINYLCARBONYL)-L-
LEUCYL]AMINO]-2-PROPANOL
A1AU20.71
BI54-PHENOXY-N-(PYRIDIN-2-YLMETHYL)BENZAMIDEA1ZYJ0.71
7221-(2,2-diphosphonoethyl)-3-(heptyloxy)pyridiniumA,B3EGT0.7
897N-[3-(TERT-BUTYLAMINO)-3-OXOPROPYL]-
N-ISOPROPYL-3-METHYL-5-{[(2S)-2-
(PYRIDIN-4-YLAMINO)PROPYL]OXY}BENZAMIDE
B,H2UUK0.74
PIL3-(CYCLOPENTYLOXY)-N-(3,5-DICHLOROPYRIDIN-
4-YL)-4-METHOXYBENZAMIDE
A,B1XM40.7
PIL3-(CYCLOPENTYLOXY)-N-(3,5-DICHLOROPYRIDIN-
4-YL)-4-METHOXYBENZAMIDE
A,B1XON0.7
NNRNicotinamide ribosideA2QT00.77
NNRNicotinamide ribosideA2QT10.77