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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02361442

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1846-[HYDROXY-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTALEN-2-
YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID
A1FCX0.7
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.82
3HP3-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCE0.71
5646-(5,5,8,8-TETRAMETHYL-5,6,7,8-
TETRAHYDRO-NAPHTALENE-2-CARBONYL)-
NAPHTALENE-2-CARBOXYLIC ACID
A1FCY0.72
26CA,B2F7I0.82
2PB2-[(DIOXIDOPHOSPHINO)OXY]BENZOATEA1SDE0.7
173BENZOYL-FORMIC ACIDA,B1SZE0.78
4FCA1YSG0.83
5PV5-PHENYLVALERIC ACIDA,B2AY90.75
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.74
3HB3-HYDROXYBENZOIC ACIDA2DKH0.74
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.73
4HP4-HYDROXYPHENYLACETATEA2YYJ0.73
4HP4-HYDROXYPHENYLACETATEA2YYM0.73
4HP4-HYDROXYPHENYLACETATEB1AI60.73
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.73
34Z3,4-dichlorobenzoateX2QVY0.79
34Z3,4-dichlorobenzoateX2QW00.79
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.76
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.76
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.75
3CAA,B2B770.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D3E5U0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B3E6B0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D3E5X0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B2H6B0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDC3E6C0.71
3BZ3-chlorobenzoateX2QVZ0.83
3BZ3-chlorobenzoateX2QVX0.83
4MA4-METHYLBENZOIC ACIDA,H2HRG0.86
1744-CHLORO-BENZOIC ACIDX3DLP0.83
1744-CHLORO-BENZOIC ACIDX1T5D0.83
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.72