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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03101981

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
L27{1-BENZYL-3-[2-BENZYL-3-OXO-4-(1-
OXO-1,2,3,4-TETRAHYDRO- ISOQUINOLIN-
4-YL)-2,3-DIHYDRO-1H-PYRROL-2-YL]-
2- HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-
FURAN-3-YL ESTER
A1NPV0.7
BNDME-A-N-BENZOYL-AMINO-9-DEOXY-NEU5ACA1OD90.73
BFN5-(acetylamino)-2,6-anhydro-3,5,9-
trideoxy-3-fluoro-9-[(phenylcarbonyl)amino]-
D-arabino-L-galacto-nononic acid
A3B690.72
SUWME-A-9-N-(NAPHTHYL-2-CARBONYL)-
AMINO-9-DEOXY-NEU5AC
A1OD70.74
TA1TAXOLA,B1JFF0.81
TA1TAXOLA,B,C2HXH0.81
TA1TAXOLA,B,N3DCO0.81
TA1TAXOLA,B,K2P4N0.81
TA1TAXOLA,B,D,F,G3EDL0.81
TA1TAXOLA,B,C2HXF0.81
TA1TAXOLA,B,C2WBE0.81
TXLTAXOTEREA,B,K1IA00.8
TXLTAXOTEREA,B1TUB0.8
FKABENZYL-CARBAMIC ACID [8-DEETHYL-
ASCOMYCIN-8-YL]ETHYL ESTER
B1A7X0.74
EJT1,3-DI(N-PROPYLOXY-A-MANNOPYRANOSYL)-
CARBOMYL 5-METHYAZIDO-BENZENE
A,B1QGL0.72
HOP(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-
5-PHENYL-1-CYCLOHEXANOL
H,L1D6V0.71
HOP(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-
5-PHENYL-1-CYCLOHEXANOL
A,B,H,L1AXS0.71
568N,N-[2,5-O-DIBENZYL-GLUCARYL]-DI-
[1-AMINO-INDAN-2-OL]
B1WBK0.7
BDUME-A-9-N-(BIPHENYL-4-CARBONYL)-
AMINO-9-DEOXY-NEU5AC
A1ODA0.75