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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02396736

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.7
3HB3-HYDROXYBENZOIC ACIDA2DKH0.7
295(2S,3S)-3-(4-fluorophenyl)-2,3-
dihydroxypropanoic acid
A,B2RJR0.76
4FCA1YSG0.76
1ZN(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy-
2,6,8-trimethyl-10-phenyldeca-4,6-
dienoic acid
C,F,M,N2IAE0.75
26CA,B2F7I0.76
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.72
12M(2-ETHYLPHENYL)METHANOLA,B2F620.71
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.73
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.75
4HP4-HYDROXYPHENYLACETATEA2YYJ0.75
4HP4-HYDROXYPHENYLACETATEA2YYM0.75
4HP4-HYDROXYPHENYLACETATEB1AI60.75
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.75
1846-[HYDROXY-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTALEN-2-
YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID
A1FCX0.74
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.75
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.73
3HP3-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCE0.72
4MA4-METHYLBENZOIC ACIDA,H2HRG0.74
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.75
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.75
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.71
1LPTRANYLCYPROMINEA,B1OJB0.73
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.73
173BENZOYL-FORMIC ACIDA,B1SZE0.79
5PV5-PHENYLVALERIC ACIDA,B2AY90.83