Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02852844
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.72 | |
959 | benzyl (2-oxopropyl)carbamate | A | 3D62 | 0.71 | |
2PM | N-[2-(BENZHYDRYLOXY)ETHYL]-N,N- DIMETHYLAMINE | A,B | 2AOT | 0.93 | |
505 | (2R)-1-(2,6-dimethylphenoxy)propan- 2-amine | A | 2VIN | 0.73 | |
RSO | R-STYRENE OXIDE | A,B | 1PWZ | 0.77 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2F4O | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJO | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CDR | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C1E | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 5PAD | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1JXQ | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 2CNO | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1CGL | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ9 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2K | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2CNL | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJP | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2M | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZB | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 9HVP | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1ESB | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1DY8 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 1PPM | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 1GEC | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KS7 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | C | 1A8G | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KKK | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | T,U,V,W,X,Y | 1QDU | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 4TMN | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5TMN | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KTO | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,C | 1TG1 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ8 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 2G58 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | Q,R,S,T,U,V | 1F9E | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CJY | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 1E8M | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KR6 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 6TMN | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KRO | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNN | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2O | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1SQZ | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1THE | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I,J | 2AZC | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5EST | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNK | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KL6 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 6PAD | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | B,I | 2C2Z | 0.73 | |
SB3 | 1,3-DIPHENYL-1-PROPYL-1-(3,3-DIMETHYL- 1,2-DIOXYPENTYL)-2-PIPERIDINE CARBOXYLATE | A | 1FKG | 0.72 | |
HC6 | (2S,2'S)-2,2'-biphenyl-4,4'-diylbis(2- hydroxy-4,4-dimethylmorpholin-4- ium) | A,B | 3F2R | 0.74 | |
HC6 | (2S,2'S)-2,2'-biphenyl-4,4'-diylbis(2- hydroxy-4,4-dimethylmorpholin-4- ium) | A,B | 3G15 | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 3ERT | 0.76 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 1S9Q | 0.76 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 1VJB | 0.76 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B,C,P,R | 2JF9 | 0.76 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B,C,D,E,F | 2GPV | 0.76 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 2GPU | 0.76 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 2P7Z | 0.76 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 2BJ4 | 0.76 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 2FSZ | 0.76 | |
RFX | (3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine | A | 3GWV | 0.71 | |
SEM | 3-AMINO-4-OXYBENZYL-2-BUTANONE | A,B | 1THE | 0.77 | |
SFX | (3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine | A | 3GWW | 0.71 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.72 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.72 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.72 | |
CTX | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINE | A,B,C | 1YA4 | 0.78 | |
RNP | (1E,2R)-1-(ISOPROPYLIMINO)-3-(1- NAPHTHYLOXY)PROPAN-2-OL | X | 1H46 | 0.71 | |
BS1 | (3-EXO)-3-(10,11-DIHYDRO-5H-DIBENZO[A,D][7]ANNULEN- 5-YLOXY)-8,8-DIMETHYL-8-AZONIABICYCLO[3.2.1]OCTANE | A,F | 2W8F | 0.77 | |
TXF | (Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}- 5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL | A,B,C,D,E | 2EWP | 0.74 | |
BGG | CARBONIC ACID MONOBENZYL ESTER | B,D | 1DLK | 0.71 | |
TAX | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINIUM | A | 1FJ5 | 0.75 |