Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02101466
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 |
SRO | SEROTONIN | A,B | 3BRN | 0.76 |  |
| SRO | SEROTONIN | A | 2QEH | 0.76 | |
IMQ | (2R,3R,4S)-2-(hydroxymethyl)-1- (quinolin-8-ylmethyl)pyrrolidine- 3,4-diol | A,B | 3EPX | 0.76 | |
ITR | IMINO-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.7 | |
TRF | N1-FORMYL-TRYPTOPHAN | A,B | 1VRK | 0.71 | |
| TRF | N1-FORMYL-TRYPTOPHAN | A,B,C,D | 1QS7 | 0.71 | |
T98 | 5-(4,4-DIMETHYL-2-THIOXO-1,4-DIHYDRO- 2H-3,1-BENZOXAZIN-6-YL)-1-METHYL- 1H-PYRROLE-2-CARBONITRILE | A,B | 1ZUC | 0.71 | |
PY7 | PYRIDIN-4-YLMETHANOL | A | 2EUR | 0.78 | |
PXM | 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)- 2-METHYLPYRIDIN-3-OL | A | 1RFT | 0.72 | |
| PXM | 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)- 2-METHYLPYRIDIN-3-OL | A,B | 2Z9V | 0.72 | |
9HP | 9-(4-HYDROXYPHENYL)-2,7-PHENANTHROLINE | A | 1PMU | 0.73 | |
2S3 | (2S)-2-(1H-indol-3-yl)pentanoic acid | B | 3C6P | 0.72 | |
TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AH0 | 0.79 | |
| TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AGZ | 0.79 | |
SIE | SULFAMIC ACID 1-DECYL-2-(4-SULFAMOYLOXYPHENYL)- 1H-INDOL-6-YL ESTER | A | 2BRP | 0.71 | |
IPL | INDOLE-3-PROPANOL PHOSPHATE | A,B | 1BEU | 0.73 | |
| IPL | INDOLE-3-PROPANOL PHOSPHATE | A,B | 1QOP | 0.73 | |
| IPL | INDOLE-3-PROPANOL PHOSPHATE | A,B | 2TRS | 0.73 | |
| IPL | INDOLE-3-PROPANOL PHOSPHATE | A | 1WXJ | 0.73 | |
| IPL | INDOLE-3-PROPANOL PHOSPHATE | A,B | 1KFC | 0.73 | |
IGP | INDOLE-3-GLYCEROL PHOSPHATE | A | 1A53 | 0.78 | |
| IGP | INDOLE-3-GLYCEROL PHOSPHATE | A,B | 2RHG | 0.78 | |
| IGP | INDOLE-3-GLYCEROL PHOSPHATE | A,B | 1KFB | 0.78 | |
| IGP | INDOLE-3-GLYCEROL PHOSPHATE | A,B | 2RH9 | 0.78 | |
| IGP | INDOLE-3-GLYCEROL PHOSPHATE | A,B | 1A5B | 0.78 | |
| IGP | INDOLE-3-GLYCEROL PHOSPHATE | A,B | 1QOQ | 0.78 | |
TPL | TRYPTOPHANOL | A | 1EE7 | 0.77 | |
PZZ | 3-{3-[(DIMETHYLAMINO)METHYL]-1H- INDOL-7-YL}PROPAN-1-OL | A | 2QHW | 0.77 | |
IAC | 1H-INDOL-3-YLACETIC ACID | B | 2P1Q | 0.72 | |
| IAC | 1H-INDOL-3-YLACETIC ACID | A | 2OYF | 0.72 | |
| IAC | 1H-INDOL-3-YLACETIC ACID | A,B | 3FVU | 0.72 | |
| IAC | 1H-INDOL-3-YLACETIC ACID | B | 2P1P | 0.72 | |
2S2 | (2S)-2-(1H-indol-3-yl)hexanoic acid | B | 3C6O | 0.71 | |
IOP | INDOLYLPROPIONIC ACID | A,B | 1AHF | 0.71 | |
| IOP | INDOLYLPROPIONIC ACID | A | 2OLI | 0.71 | |
| IOP | INDOLYLPROPIONIC ACID | A,B | 2AY5 | 0.71 | |
RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A | 1YV5 | 0.72 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A,B | 1RQJ | 0.72 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A | 1YQ7 | 0.72 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A | 1YHL | 0.72 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A | 2QIS | 0.72 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A,B | 2O1O | 0.72 | |
DRP | 2-DEOXYRIBOFURANOSYL-PYRIDINE-5'- MONOPHOSPHATE | A,B | 1JES | 0.77 | |
FIP | 5-FLUOROINDOLE PROPANOL PHOSPHATE | A,B | 1FUY | 0.72 | |
| FIP | 5-FLUOROINDOLE PROPANOL PHOSPHATE | A,B | 1A50 | 0.72 | |
| FIP | 5-FLUOROINDOLE PROPANOL PHOSPHATE | A,B | 1A5S | 0.72 | |
ELP | (1R)-1-[((1E)-{3-HYDROXY-2-METHYL- 5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYLENE)AMINO]-1-PHENYLETHYLPHOSPHONIC ACID | A | 1M0P | 0.71 | |
NCT | (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T | 1UW6 | 0.74 | |
| NCT | (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE | A | 1P2Y | 0.74 | |
| NCT | (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE | A | 1P7R | 0.74 | |
3LP | 1-(CYCLOHEXYLAMINO)-3-(6-METHYL- 3,4-DIHYDRO-1H-CARBAZOL-9(2H)-YL)PROPAN- 2-OL | A,B,C,D,E,F | 2P6G | 0.7 | |
N5I | 1-(2-DEOXY-5-O-PHOSPHONO-BETA-D- ERYTHRO-PENTOFURANOSYL)-5-NITRO- 1H-INDOLE | A,C,E,F,I,J,K | 2OYQ | 0.7 | |
4MF | 1-(2-DEOXY-5-O-PHOSPHONO-BETA-D- ERYTHRO-PENTOFURANOSYL)-4-METHYL- 1H-INDOLE | C | 2OXM | 0.74 | |
| 4MF | 1-(2-DEOXY-5-O-PHOSPHONO-BETA-D- ERYTHRO-PENTOFURANOSYL)-4-METHYL- 1H-INDOLE | B,C | 2OYT | 0.74 | |
PYF | 3-PYRIDINYLCARBINOL | A,B | 1R16 | 0.8 | |
PRR | 3-(METHYL-PYRIDINIUM)ALANINE | H,I,J | 7KME | 0.72 | |
3IB | 3-INDOLEBUTYRIC ACID | A,B | 2AY6 | 0.7 | |
| 3IB | 3-INDOLEBUTYRIC ACID | A,B,C,E | 2GJ6 | 0.7 | |
11P | [(7R)-6,7-dihydro-5H-cyclopenta[c]pyridin- 7-yl(hydroxy)methylene]bis(phosphonic acid) | A | 2RAH | 0.71 | |
3ID | 3H-INDOLE-5,6-DIOL | A | 1F9B | 0.73 | |
| 3ID | 3H-INDOLE-5,6-DIOL | A | 1OYO | 0.73 | |
TOX | 2-AMINO-3-(1-HYDROPEROXY-1H-INDOL- 3-YL)PROPAN-1-OL | A,B | 2DV2 | 0.76 | |
| TOX | 2-AMINO-3-(1-HYDROPEROXY-1H-INDOL- 3-YL)PROPAN-1-OL | A,B | 2FXJ | 0.76 | |
MIB | (3E)-4-(1-METHYL-1H-INDOL-3-YL)BUT- 3-EN-2-ONE | A | 1ZS5 | 0.74 | |
PAA | (N-METHYLPYRIDYL)ACETIC ACID | I | 1HBT | 0.73 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A,B | 1QPA | 0.74 | |
| HTR | BETA-HYDROXYTRYPTOPHANE | A,B | 1B80 | 0.74 | |
| HTR | BETA-HYDROXYTRYPTOPHANE | A | 1ROV | 0.74 | |
ASE | N-ACETYL SEROTONIN | A | 1NAS | 0.73 | |
PYU | 2-(1H-pyrrol-1-ylcarbonyl)benzene- 1,3,5-triol | A,B | 3EKO | 0.72 | |
3IL | 3-(INDOL-3-YL) LACTATE | A | 2A7P | 0.74 | |
IOS | 3-SULFOOXY-1H-INDOLE | A,B | 2BXH | 0.7 | |