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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02792459

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
0A9methyl L-phenylalaninateA1AY20.73
0A9methyl L-phenylalaninateI5ER10.73
0A9methyl L-phenylalaninateI,P1HDT0.73
1LPTRANYLCYPROMINEA,B1OJB0.76
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.7
4HP4-HYDROXYPHENYLACETATEA2YYJ0.7
4HP4-HYDROXYPHENYLACETATEA2YYM0.7
4HP4-HYDROXYPHENYLACETATEB1AI60.7
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.7
173BENZOYL-FORMIC ACIDA,B1SZE0.74
4PH4-methyl-L-phenylalanineB,C3BV90.75
26CA,B2F7I0.76
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.75
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.71
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.71
5PV5-PHENYLVALERIC ACIDA,B2AY90.87
2HRHEXYLPHOSPHONIC ACID (R)-2-METHYL-
3-PHENYLPROPYL ESTER
X1YS10.71
2HSHEXYLPHOSPHONIC ACID (S)-2-METHYL-
3-PHENYLPROPYL ESTER
X1YS20.71
4FCA1YSG0.77
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.73
5646-(5,5,8,8-TETRAMETHYL-5,6,7,8-
TETRAHYDRO-NAPHTALENE-2-CARBONYL)-
NAPHTALENE-2-CARBOXYLIC ACID
A1FCY0.71
4MA4-METHYLBENZOIC ACIDA,H2HRG0.74
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.71
256PHENYL(SULFO)ACETIC ACIDA1O4Q0.72
3PL3-PHENYLPROPANALE1Y3G0.74
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.7
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.71