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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00002926

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
23F(2Z)-2-AMINO-3-PHENYLACRYLIC ACIDA1VRZ0.71
AC6P-HYDROXYACETOPHENONEA2GQ80.73
AC6P-HYDROXYACETOPHENONEX2O480.73
173BENZOYL-FORMIC ACIDA,B1SZE0.85
5PV5-PHENYLVALERIC ACIDA,B2AY90.78
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.72
2PB2-[(DIOXIDOPHOSPHINO)OXY]BENZOATEA1SDE0.7
1744-CHLORO-BENZOIC ACIDX3DLP0.73
1744-CHLORO-BENZOIC ACIDX1T5D0.73
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.81
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.73
3HB3-HYDROXYBENZOIC ACIDA2DKH0.73
4MA4-METHYLBENZOIC ACIDA,H2HRG0.79
3BZ3-chlorobenzoateX2QVZ0.73
3BZ3-chlorobenzoateX2QVX0.73
AC01-PHENYLETHANONEA1ZK10.88
AC01-PHENYLETHANONEA1ZK40.88
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.71
4HP4-HYDROXYPHENYLACETATEA2YYJ0.71
4HP4-HYDROXYPHENYLACETATEA2YYM0.71
4HP4-HYDROXYPHENYLACETATEB1AI60.71
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.71
7912-PHENYLMALONIC ACIDA1O4P0.71
26CA,B2F7I0.74
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.71
1LPTRANYLCYPROMINEA,B1OJB0.73
3PL3-PHENYLPROPANALE1Y3G0.75
4FCA1YSG0.75
9TA1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)-
ETHYLAMINO]-ANTHRAQUINONE
A,B1FDG0.8