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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02443397

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.72
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.74
3HP3-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCE0.71
5PV5-PHENYLVALERIC ACIDA,B2AY90.86
173BENZOYL-FORMIC ACIDA,B1SZE0.78
0A9methyl L-phenylalaninateA1AY20.7
0A9methyl L-phenylalaninateI5ER10.7
0A9methyl L-phenylalaninateI,P1HDT0.7
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.74
4FCA1YSG0.8
26CA,B2F7I0.79
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.75
4HP4-HYDROXYPHENYLACETATEA2YYJ0.75
4HP4-HYDROXYPHENYLACETATEA2YYM0.75
4HP4-HYDROXYPHENYLACETATEB1AI60.75
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.75
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.76
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.76
4PH4-methyl-L-phenylalanineB,C3BV90.71
4MA4-METHYLBENZOIC ACIDA,H2HRG0.75
1LPTRANYLCYPROMINEA,B1OJB0.77
5646-(5,5,8,8-TETRAMETHYL-5,6,7,8-
TETRAHYDRO-NAPHTALENE-2-CARBONYL)-
NAPHTALENE-2-CARBOXYLIC ACID
A1FCY0.71
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.75
7912-PHENYLMALONIC ACIDA1O4P0.87
3PL3-PHENYLPROPANALE1Y3G0.73
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.77