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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00049274

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3XH3-Hydroxyhippuric acidA3E9K0.73
4PH4-methyl-L-phenylalanineB,C3BV90.7
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.72
3HB3-HYDROXYBENZOIC ACIDA2DKH0.72
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.73
3AB3-aminobenzamideA,B,C,D3GOY0.7
173BENZOYL-FORMIC ACIDA,B1SZE0.74
4MA4-METHYLBENZOIC ACIDA,H2HRG0.81
0A9methyl L-phenylalaninateA1AY20.7
0A9methyl L-phenylalaninateI5ER10.7
0A9methyl L-phenylalaninateI,P1HDT0.7
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.79
1744-CHLORO-BENZOIC ACIDX3DLP0.73
1744-CHLORO-BENZOIC ACIDX1T5D0.73
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.74
3BZ3-chlorobenzoateX2QVZ0.73
3BZ3-chlorobenzoateX2QVX0.73
26CA,B2F7I0.75
3MB3-METHOXYBENZAMIDEA3PAX0.77
4BA4-[(2-CARBOXY-ETHYLAMINO)-METHYL]-
BENZOIC ACID
C1FAV0.82
2013-AMIDO-5-BIPHENYL-BENZOIC ACIDA2B0M0.83
3HA3-HYDROXYANTHRANILIC ACIDA,B1U1W0.71
3HA3-HYDROXYANTHRANILIC ACIDA1YFY0.71
4NB4-NITROBENZOIC ACIDA,B3CHT0.72
4MB4-[(METHYLSULFONYL)AMINO]BENZOIC ACIDA,B2HDS0.73
4FCA1YSG0.75