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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02791434

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.73
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.73
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.73
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.73
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.72
5PV5-PHENYLVALERIC ACIDA,B2AY90.78
7912-PHENYLMALONIC ACIDA1O4P0.78
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J2FIV0.74
ALNNAPHTHALEN-2-YL-3-ALANINEA,B1B0H0.74
ALNNAPHTHALEN-2-YL-3-ALANINEB1FIV0.74
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J3FIV0.74
BIP2-BENZYL-3-IODOPROPANOIC ACIDA,B,C,D1BAV0.75
4MA4-METHYLBENZOIC ACIDA,H2HRG0.71
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.71
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S1YYL0.73
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S2I5Y0.73
BFLA,B1Q4G0.83
173BENZOYL-FORMIC ACIDA,B1SZE0.72
26CA,B2F7I0.75
BNABIS-(NAPHTHYL-1-METHYL) ACETIC ACIDI4ER10.76
BNABIS-(NAPHTHYL-1-METHYL) ACETIC ACIDA1FQ50.76
APD3-METHYLPHENYLALANINEA,B,C1GMY0.7
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.72
AN13-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACIDH,Y1LO30.77
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.71
4FCA1YSG0.75
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.7
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.7