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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00043446

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4TB4-(2-THIENYL)BUTYRIC ACIDA,B2AY80.72
4FCA1YSG0.71
BFLA,B1Q4G0.79
BIP2-BENZYL-3-IODOPROPANOIC ACIDA,B,C,D1BAV0.73
BZMBENZOIC ACID PHENYLMETHYLESTERA,B1DZM0.72
DPHDEAMINO-METHYL-PHENYLALANINEA1OS00.75
DPHDEAMINO-METHYL-PHENYLALANINEA,B2JJI0.75
DPHDEAMINO-METHYL-PHENYLALANINEA,B2JJJ0.75
DPHDEAMINO-METHYL-PHENYLALANINEA,B2VS20.75
DPHDEAMINO-METHYL-PHENYLALANINEA,B1OD10.75
DPHDEAMINO-METHYL-PHENYLALANINEE1EPR0.75
CP5(2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}-
2-PHENYLACRYLATE
A1SCW0.72
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.76
7912-PHENYLMALONIC ACIDA1O4P0.74
DFADIPHENYLACETIC ACIDA,B,C1GMY0.81
173BENZOYL-FORMIC ACIDA,B1SZE0.72
5PV5-PHENYLVALERIC ACIDA,B2AY90.76
FBCA,B2B9A0.7
CPMS-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE-
S-METHANE
A1CPS0.76
EMT2-(ETHYLMERCURI-THIO)-BENZOIC ACIDA,B1KDG0.78
EMT2-(ETHYLMERCURI-THIO)-BENZOIC ACIDA,B,C,D1O9L0.78
26CA,B2F7I0.7
BTP2-THIOMETHYL-3-PHENYLPROPANOIC ACIDA,B1JAO0.76
CLT4-PHENYL-BUTANOIC ACIDA1THL0.76
CLT4-PHENYL-BUTANOIC ACIDA,B2AY70.76
CLT4-PHENYL-BUTANOIC ACIDE,I1TMN0.76
BZSL-BENZYLSUCCINIC ACIDA1CBX0.72
BZSL-BENZYLSUCCINIC ACIDA1HYT0.72
BZSL-BENZYLSUCCINIC ACIDA,B1WHT0.72
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.7
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.7