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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03215563

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4MU7-hydroxy-4-methyl-2H-chromen-2-
one
A,B3ETS0.71
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.78
3HB3-HYDROXYBENZOIC ACIDA2DKH0.78
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.78
4HP4-HYDROXYPHENYLACETATEA2YYJ0.78
4HP4-HYDROXYPHENYLACETATEA2YYM0.78
4HP4-HYDROXYPHENYLACETATEB1AI60.78
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.78
23A2,3-DIHYDROXYBENZALDEHYDEA,B,C,D2DVX0.73
1137,8-DIHYDROXY-1-METHOXY-3-METHYL-
10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3-
B]CHROMENE-9-CARBOXYLIC ACID
A,B1KR30.74
1137,8-DIHYDROXY-1-METHOXY-3-METHYL-
10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3-
B]CHROMENE-9-CARBOXYLIC ACID
A,B1HLK0.74
3HP3-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCE0.82
2PB2-[(DIOXIDOPHOSPHINO)OXY]BENZOATEA1SDE0.75
34D3,5-DIHYDROXYBENZOATEA,B2BX70.84
2HI(2S,3R)-2,7-DIHYDROXY-3-(4-HYDROXYPHENYL)-
2,3-DIHYDRO-4H-CHROMEN-4-ONE
A1ZG30.75
3CAA,B2B770.76
1FL5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-
BENZOIC ACID
A,B2BXE0.81
1FL5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-
BENZOIC ACID
A,B3D2T0.81
2HC(2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACIDA,B1V5Z0.73
2MP3,4-DIMETHYLPHENOLA1L5O0.71
2992,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATEA1O4E0.72
AC6P-HYDROXYACETOPHENONEA2GQ80.81
AC6P-HYDROXYACETOPHENONEX2O480.81
7893-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)-
1H-INDEN-1-ONE
A,B1ZAF0.73
A045-[2-(TRIFLUOROMETHOXY)PHENYL]-
2-FUROIC ACID
A2Q940.72
4MA4-METHYLBENZOIC ACIDA,H2HRG0.72
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.7
226naphthalene-1,2,4,5,7-pentolA,B2NZ50.71