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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03082653

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1LPTRANYLCYPROMINEA,B1OJB0.71
0A9methyl L-phenylalaninateA1AY20.73
0A9methyl L-phenylalaninateI5ER10.73
0A9methyl L-phenylalaninateI,P1HDT0.73
4TB4-(2-THIENYL)BUTYRIC ACIDA,B2AY80.7
173BENZOYL-FORMIC ACIDA,B1SZE0.7
4PH4-methyl-L-phenylalanineB,C3BV90.73
CPMS-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE-
S-METHANE
A1CPS0.96
7912-PHENYLMALONIC ACIDA1O4P0.75
BFLA,B1Q4G0.77
BIP2-BENZYL-3-IODOPROPANOIC ACIDA,B,C,D1BAV0.8
CLT4-PHENYL-BUTANOIC ACIDA1THL0.8
CLT4-PHENYL-BUTANOIC ACIDA,B2AY70.8
CLT4-PHENYL-BUTANOIC ACIDE,I1TMN0.8
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.71
APD3-METHYLPHENYLALANINEA,B,C1GMY0.73
DFADIPHENYLACETIC ACIDA,B,C1GMY0.77
BTP2-THIOMETHYL-3-PHENYLPROPANOIC ACIDA,B1JAO0.88
BZSL-BENZYLSUCCINIC ACIDA1CBX0.78
BZSL-BENZYLSUCCINIC ACIDA1HYT0.78
BZSL-BENZYLSUCCINIC ACIDA,B1WHT0.78
CXAPHENYLALANINE-N-SULFONAMIDEA1IY70.71
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.71
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.71
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.71
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.71
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.78
5PV5-PHENYLVALERIC ACIDA,B2AY90.82
BCSBENZYLCYSTEINEA,B,G,H10GS0.72
BCSBENZYLCYSTEINEA1EH80.72