Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02245224
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 |
OHT | 4-HYDROXYTAMOXIFEN | A | 3ERT | 0.7 |  |
| OHT | 4-HYDROXYTAMOXIFEN | A,B | 1S9Q | 0.7 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B | 1VJB | 0.7 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B,C,P,R | 2JF9 | 0.7 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B,C,D,E,F | 2GPV | 0.7 | |
| OHT | 4-HYDROXYTAMOXIFEN | A | 2GPU | 0.7 | |
| OHT | 4-HYDROXYTAMOXIFEN | A | 2P7Z | 0.7 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B | 2BJ4 | 0.7 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B | 2FSZ | 0.7 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.84 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.84 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.84 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.84 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.84 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.84 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.84 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.84 | |
CMZ | (2S)-1-(2,5-dimethylphenoxy)-3- morpholin-4-ylpropan-2-ol | A | 2OF0 | 0.73 | |
TXF | (Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}- 5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL | A,B,C,D,E | 2EWP | 0.71 | |
OX3 | 4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOH | 0.71 | |
OX5 | 4-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIME | A,B,C | 2OOZ | 0.73 | |
VXX | VANILLATE | A,B | 1WB6 | 0.7 | |
BPY | BIPHENYL-2,3-DIOL | A | 1KMY | 0.72 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.72 | |
| BPY | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.72 | |
| BPY | BIPHENYL-2,3-DIOL | A | 1EIR | 0.72 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.72 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KWC | 0.72 | |
| BPY | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.72 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.73 | |
LDP | L-DOPAMINE | A,B | 2A3R | 0.73 | |
| LDP | L-DOPAMINE | A | 5PAH | 0.73 | |
| LDP | L-DOPAMINE | A,B | 2QMZ | 0.73 | |
| LDP | L-DOPAMINE | A,B | 2VQ5 | 0.73 | |
261 | 2-ethoxyphenol | X | 2RB1 | 0.74 | |
FIL | (1E)-1-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]ETHANONE O- (AMINOCARBONYL)OXIME | A,B | 1XLZ | 0.74 | |
BP7 | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.7 | |
HV7 | 1-METHYLAMINE-2-HYDROXY-4-METHOXY- BENZENE | C | 1A8G | 0.71 | |
TON | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.7 | |
SXX | SINAPINATE | A,B | 1WB4 | 0.73 | |
HFL | 5-(3,3-DIHYDROXYPROPENY)-3-METHOXY- BENZENE-1,2-DIOL | C,F | 1KYW | 0.75 | |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.78 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | B,D,E,F | 2VSS | 0.72 | |
| V55 | 4-hydroxy-3-methoxybenzaldehyde | A,B,D,E,F | 2VSU | 0.72 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.77 | |
M07 | (5R,7R,8S,9S,10R)-7-(HYDROXYMETHYL)- 3-(4-METHOXYPHENYL)-1,6-DIOXA-2- AZASPIRO[4.5]DEC-2-ENE-8,9,10-TRIOL | A | 2QRG | 0.72 | |
ESM | 1,3,5(10)-ESTRATRIEN-2,3,17-BETA- TRIOL 2-METHYL ETHER | A | 1LHW | 0.7 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.78 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.77 | |
RNP | (1E,2R)-1-(ISOPROPYLIMINO)-3-(1- NAPHTHYLOXY)PROPAN-2-OL | X | 1H46 | 0.76 | |
UQ6 | 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA- 2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY- 6-METHYL-BENZENE-1,4-DIOL | C,D,E | 1EZV | 0.71 | |
| UQ6 | 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA- 2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY- 6-METHYL-BENZENE-1,4-DIOL | A,C,D,E | 1P84 | 0.71 | |
| UQ6 | 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA- 2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY- 6-METHYL-BENZENE-1,4-DIOL | C,D,E | 2IBZ | 0.71 | |
| UQ6 | 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA- 2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY- 6-METHYL-BENZENE-1,4-DIOL | A,C,D,E | 1KB9 | 0.71 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.72 | |
| EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.72 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.76 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.73 | |
| MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.73 | |
| MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.73 | |
8CM | 8-HYDROXYCOUMARIN | A | 2H8Z | 0.73 | |
ZHH | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.7 | |