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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00928058

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.74
3PL3-PHENYLPROPANALE1Y3G0.71
4MA4-METHYLBENZOIC ACIDA,H2HRG0.76
5PV5-PHENYLVALERIC ACIDA,B2AY90.84
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.73
4HP4-HYDROXYPHENYLACETATEA2YYJ0.73
4HP4-HYDROXYPHENYLACETATEA2YYM0.73
4HP4-HYDROXYPHENYLACETATEB1AI60.73
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.73
173BENZOYL-FORMIC ACIDA,B1SZE0.77
7912-PHENYLMALONIC ACIDA1O4P0.85
AC01-PHENYLETHANONEA1ZK10.71
AC01-PHENYLETHANONEA1ZK40.71
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.74
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.74
4PH4-methyl-L-phenylalanineB,C3BV90.71
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.71
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.75
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.71
0A9methyl L-phenylalaninateA1AY20.71
0A9methyl L-phenylalaninateI5ER10.71
0A9methyl L-phenylalaninateI,P1HDT0.71
1LPTRANYLCYPROMINEA,B1OJB0.75
AN13-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACIDH,Y1LO30.73
4FCA1YSG0.73
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.77
26CA,B2F7I0.72