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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03380403

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GCSD-GLUCOSAMINEA3CO40.72
GCSD-GLUCOSAMINEA1QGI0.72
GCSD-GLUCOSAMINEA,B2VZS0.72
GCSD-GLUCOSAMINEA1E9L0.72
GCSD-GLUCOSAMINEA,B,C,D3FXI0.72
GCSD-GLUCOSAMINEA,B2VZV0.72
PA1PAROMOMYCIN (RING 1)A1PBR0.72
PA1PAROMOMYCIN (RING 1)A1QKC0.72
PA1PAROMOMYCIN (RING 1)A1QFG0.72
PA1PAROMOMYCIN (RING 1)A1FI10.72
PA1PAROMOMYCIN (RING 1)A,B,C,D3FXI0.72
PA1PAROMOMYCIN (RING 1)A1QFF0.72
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7Y0.71
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7X0.71
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R810.71
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7V0.71
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R800.71
NB1(3AR,5R,6S,7R,7AR)-5-(HYDROXYMETHYL)-
2-PROPYL-5,6,7,7A-TETRAHYDRO-3AH-
PYRANO[3,2-D][1,3]THIAZOLE-6,7-
DIOL
A,B2J4G0.72
NGT3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-
2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-
PYRANO[3,2-D]THIAZOLE-6,7-DIOL
A,B2EPN0.74
NGT3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-
2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-
PYRANO[3,2-D]THIAZOLE-6,7-DIOL
A2W920.74
NGT3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-
2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-
PYRANO[3,2-D]THIAZOLE-6,7-DIOL
A,B,C,D2CHN0.74
NGT3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-
2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-
PYRANO[3,2-D]THIAZOLE-6,7-DIOL
A,B,D,F3FHQ0.74
NGT3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-
2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-
PYRANO[3,2-D]THIAZOLE-6,7-DIOL
A1HP50.74
NGT3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-
2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-
PYRANO[3,2-D]THIAZOLE-6,7-DIOL
A,B1NP00.74
NGT3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-
2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-
PYRANO[3,2-D]THIAZOLE-6,7-DIOL
A,B,C,D,E,F,
G,H
2GK10.74
NGO2-METHYL-4,5-DIHYDRO-(1,2-DIDEOXY-
ALPHA-D-GLUCOPYRANOSO)[2,1-D]-1,3-
OXAZOLE
A,B,C,D1E6Z0.9
GCN3-DEOXY-D-GLUCOSAMINEA1FI10.72
GCN3-DEOXY-D-GLUCOSAMINEA1QFG0.72
GCN3-DEOXY-D-GLUCOSAMINEA1QKC0.72
GCN3-DEOXY-D-GLUCOSAMINEA,B2GRX0.72
GCN3-DEOXY-D-GLUCOSAMINEA1QJQ0.72
GCN3-DEOXY-D-GLUCOSAMINEA1QFF0.72
MYGGLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOLA1GYM0.72
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
B2F4S0.7
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
A,B2FCX0.7
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
B2ET80.7
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.72