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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03498550

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CTX(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)-
PHENOXY]-N,N-DIMETHYLETHANAMINE
A,B,C1YA40.76
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.7
B65(1R)-4-(3-phenoxyphenyl)-1-phosphonobutane-
1-sulfonic acid
A2ZCQ0.73
E4D(2S,3R)-2-(4-(2-(PIPERIDIN-1-YL)ETHOXY)PHENYL)-
2,3-DIHYDRO-3-(4-HYDROXYPHENYL)BENZO[B][1,4]OXATHIIN-
6-OL
A1SJ00.7
AL9N-[(4-METHOXYPHENYL)METHYL]2,5-
THIOPHENEDESULFONAMIDE
A1BN40.71
RS14-[4-(4-CHLORO-PHENOXY)-BENZENESULFONYLMETHYL]-
TETRAHYDRO-PYRAN-4-CARBOXYLIC ACID HYDROXYAMIDE
A,B830C0.7
BT23-[4-(2-PYRROLIDIN-1-YL-ETHOXY)-
BENZYL]-2-4-(2-PYRROLIDIN-1-YL-
ETHOXY)-PHENYL] -BENZO[B]THIOPHENE
B,H1D3Q0.71
OHT4-HYDROXYTAMOXIFENA3ERT0.74
OHT4-HYDROXYTAMOXIFENA,B1S9Q0.74
OHT4-HYDROXYTAMOXIFENA,B1VJB0.74
OHT4-HYDROXYTAMOXIFENA,B,C,P,R2JF90.74
OHT4-HYDROXYTAMOXIFENA,B,C,D,E,F2GPV0.74
OHT4-HYDROXYTAMOXIFENA2GPU0.74
OHT4-HYDROXYTAMOXIFENA2P7Z0.74
OHT4-HYDROXYTAMOXIFENA,B2BJ40.74
OHT4-HYDROXYTAMOXIFENA,B2FSZ0.74
EINA1ZS00.72
81A2-METHANESULFONYL-BENZENESULFONIC ACID 3-
METHYL-5-((1-AMIDINOAMINOOXYMETHYL-
CYCLOPROPYL)METHYLOXY)-PHENYLESTER
H,I1T4U0.73
2C72-(cycloheptylmethyl)-1,1-dioxido-
1-benzothiophen-6-yl sulfamate
A3DD80.7
294N-hydroxy-4-({4-[4-(trifluoromethyl)phenoxy]phenyl}sulfonyl)tetrahydro-
2H-pyran-4-carboxamide
A,B3B8Z0.79
TRTFRAGMENT OF TRITON X-100A,E2I0U0.71
TRTFRAGMENT OF TRITON X-100A,B1OIZ0.71
FINA1ZVX0.72
RS2N-HYDROXY-2-[4-(4-PHENOXY-BENZENESULFONYL)-
TETRAHYDRO-PYRAN-4-YL]-ACETAMIDE
A966C0.76
4403-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-
1-thiol
A3B920.77
TXF(Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}-
5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL
A,B,C,D,E2EWP0.73
TAX(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)-
PHENOXY]-N,N-DIMETHYLETHANAMINIUM
A1FJ50.73
CBP2-{4-[4-(4-CHLORO-PHENOXY)-BENZENESULFONYL]-
TETRAHYDRO-PYRAN-4-YL}-N-HYDROXY-
ACETAMIDE
A,B456C0.71
CBP2-{4-[4-(4-CHLORO-PHENOXY)-BENZENESULFONYL]-
TETRAHYDRO-PYRAN-4-YL}-N-HYDROXY-
ACETAMIDE
A,B1CXV0.71
D32(2,3-dimethyl-4-{[2-(prop-2-yn-
1-yloxy)-4-{[4-(trifluoromethyl)phenoxy]methyl}phenyl]sulfanyl}phenoxy)acetic acid
A3GZ90.71
MSB1-METHYLOXY-4-SULFONE-BENZENEA1EUB0.7
MSB1-METHYLOXY-4-SULFONE-BENZENEA1BM60.7