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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00825288

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
173BENZOYL-FORMIC ACIDA,B1SZE0.73
5PV5-PHENYLVALERIC ACIDA,B2AY90.86
4FCA1YSG0.71
4PH4-methyl-L-phenylalanineB,C3BV90.72
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.74
ARL7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA-
2,4,6-TRIENOIC ACID
A1NQ70.71
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.71
0A9methyl L-phenylalaninateA1AY20.72
0A9methyl L-phenylalaninateI5ER10.72
0A9methyl L-phenylalaninateI,P1HDT0.72
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.7
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.71
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.71
AC01-PHENYLETHANONEA1ZK10.71
AC01-PHENYLETHANONEA1ZK40.71
4MA4-METHYLBENZOIC ACIDA,H2HRG0.73
AN13-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACIDH,Y1LO30.78
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.73
1LPTRANYLCYPROMINEA,B1OJB0.77
3PL3-PHENYLPROPANALE1Y3G0.73
26CA,B2F7I0.7
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.76
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.76
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.76
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.76
7912-PHENYLMALONIC ACIDA1O4P0.82
APD3-METHYLPHENYLALANINEA,B,C1GMY0.74