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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00846165

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.72
3PL3-PHENYLPROPANALE1Y3G0.71
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.74
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.74
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.74
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.74
BNABIS-(NAPHTHYL-1-METHYL) ACETIC ACIDI4ER10.77
BNABIS-(NAPHTHYL-1-METHYL) ACETIC ACIDA1FQ50.77
BFLA,B1Q4G0.8
0A9methyl L-phenylalaninateA1AY20.7
0A9methyl L-phenylalaninateI5ER10.7
0A9methyl L-phenylalaninateI,P1HDT0.7
ARL7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA-
2,4,6-TRIENOIC ACID
A1NQ70.71
5PV5-PHENYLVALERIC ACIDA,B2AY90.84
AN13-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACIDH,Y1LO30.78
4PH4-methyl-L-phenylalanineB,C3BV90.71
BIP2-BENZYL-3-IODOPROPANOIC ACIDA,B,C,D1BAV0.82
APD3-METHYLPHENYLALANINEA,B,C1GMY0.72
CIN4-CARBOXYCINNAMIC ACIDA,B,C,D1HAB0.72
CIN4-CARBOXYCINNAMIC ACIDA,B1T6J0.72
173BENZOYL-FORMIC ACIDA,B1SZE0.71
1LPTRANYLCYPROMINEA,B1OJB0.75
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.72
4MA4-METHYLBENZOIC ACIDA,H2HRG0.72
BZSL-BENZYLSUCCINIC ACIDA1CBX0.91
BZSL-BENZYLSUCCINIC ACIDA1HYT0.91
BZSL-BENZYLSUCCINIC ACIDA,B1WHT0.91
7912-PHENYLMALONIC ACIDA1O4P0.8
BTP2-THIOMETHYL-3-PHENYLPROPANOIC ACIDA,B1JAO0.79