Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03801440
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 |
5Z5 | 5-[(Z)-(5-CHLORO-2-OXO-1,2-DIHYDRO- 3H-INDOL-3-YLIDENE)METHYL]-N-(DIETHYLAMINO)ETHYL]- 2,4-DIMETHYL-1H-PYRROLE-3-CARBOXAMIDE | A | 2JAV | 0.72 | |
288 | 5-CHLORO-1H-INDOLE-2-CARBOXYLIC ACID{[CYCLOPENTYL- (2-HYDROXY-ETHYL)-CARBAMOYL]-METHYL}- AMIDE | A,B | 1XOI | 0.72 | |
ICO | 1H-INDOLE-3-CARBOXYLIC ACID | L | 2PIP | 0.73 | |
TPL | TRYPTOPHANOL | A | 1EE7 | 0.73 | |
J60 | 5-[(E)-(5-CHLORO-2-OXO-1,2-DIHYDRO- 3H-INDOL-3-YLIDENE)METHYL]-N-[2- (DIETHYLAMINO)ETHYL]-2,4-DIMETHYL- 1H-PYRROLE-3-CARBOXAMIDE | A,B | 2JAM | 0.72 | |
SU1 | 3-[(3-(2-CARBOXYETHYL)-4-METHYLPYRROL- 2-YL)METHYLENE]-2-INDOLINONE | A,B | 1FGI | 0.72 | |
CRR | 3,4-DI-1H-INDOL-3-YL-1H-PYRROLE- 2,5-DICARBOXYLIC ACID | A | 2Z3U | 0.71 | |
KAW | N-{(5S)-4,4-dihydroxy-6-phenyl- 5-[(phenylcarbonyl)amino]hexanoyl}- L-tryptophan | A | 3BKL | 0.71 | |
BTR | 6-BROMO-TRYPTOPHAN | A | 1WCT | 0.7 | |
TOX | 2-AMINO-3-(1-HYDROPEROXY-1H-INDOL- 3-YL)PROPAN-1-OL | A,B | 2DV2 | 0.7 | |
TOX | 2-AMINO-3-(1-HYDROPEROXY-1H-INDOL- 3-YL)PROPAN-1-OL | A,B | 2FXJ | 0.7 | |
CTE | 7-CHLOROTRYPTOPHAN | A | 2AR8 | 0.76 | |
CTE | 7-CHLOROTRYPTOPHAN | A | 2V7L | 0.76 | |
ITR | IMINO-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.74 | |
PAT | ALPHA-PHOSPHONO-TRYPTOPHAN | A,B | 1I73 | 0.72 | |
TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AH0 | 0.71 | |
TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AGZ | 0.71 | |
DTR | D-TRYPTOPHAN | A,B,C,D | 2R3C | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1XY8 | 0.74 | |
DTR | D-TRYPTOPHAN | A,B,C,H,K,L | 2R5D | 0.74 | |
DTR | D-TRYPTOPHAN | A | 2V7K | 0.74 | |
DTR | D-TRYPTOPHAN | A,D | 1CZQ | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1DFY | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1XY5 | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1NXN | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1TKF | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1YL9 | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1XXZ | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1XY4 | 0.74 | |
DTR | D-TRYPTOPHAN | A,D | 2Q3I | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1QFB | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1DFZ | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1XY9 | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1XY6 | 0.74 | |
DTR | D-TRYPTOPHAN | A | 2SOC | 0.74 | |
DTR | D-TRYPTOPHAN | A | 2JUE | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1SOC | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1YL8 | 0.74 | |
DTR | D-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.74 | |
DTR | D-TRYPTOPHAN | A,B | 2Q33 | 0.74 | |
DTR | D-TRYPTOPHAN | A | 1DG0 | 0.74 | |
DTR | D-TRYPTOPHAN | A,B,C,H,K,L | 2R5B | 0.74 | |
809 | 4-(2-chlorophenyl)-8-(2-hydroxyethyl)- 6-methylpyrrolo[3,4-e]indole-1,3(2H,6H)- dione | A | 3CR0 | 0.74 | |
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 | |
4FW | 4-FLUOROTRYPTOPHANE | A | 1RM9 | 0.73 | |
FTR | FLUOROTRYPTOPHANE | A | 2JT8 | 0.73 | |
FTR | FLUOROTRYPTOPHANE | A,B | 1NF0 | 0.73 | |
FTR | FLUOROTRYPTOPHANE | A | 2JTZ | 0.73 | |
FTR | FLUOROTRYPTOPHANE | A,B | 1I45 | 0.73 | |
FTR | FLUOROTRYPTOPHANE | A,B | 2ZNX | 0.73 | |
FTR | FLUOROTRYPTOPHANE | A,B | 1NEY | 0.73 | |
FTR | FLUOROTRYPTOPHANE | A,B | 5FWG | 0.73 | |
3IO | 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID | A,B,C,D | 1XES | 0.74 | |
3IO | 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID | B,C,D | 1XET | 0.74 | |
2S3 | (2S)-2-(1H-indol-3-yl)pentanoic acid | B | 3C6P | 0.71 | |
A46 | 5-chloro-N-{4-[(1R)-1,2-dihydroxyethyl]phenyl}- 1H-indole-2-carboxamide | A,B | 2ZB2 | 0.71 | |
IOP | INDOLYLPROPIONIC ACID | A,B | 1AHF | 0.73 | |
IOP | INDOLYLPROPIONIC ACID | A | 2OLI | 0.73 | |
IOP | INDOLYLPROPIONIC ACID | A,B | 2AY5 | 0.73 | |
FT6 | 6-FLUORO-L-TRYPTOPHAN | A,B | 2NW9 | 0.73 | |
057 | N-(2-hydroxy-1,1-dimethylethyl)- 1-methyl-3-(1H-pyrrolo[2,3-b]pyridin- 2-yl)-1H-indole-5-carboxamide | A,B | 3FQH | 0.71 | |
TRF | N1-FORMYL-TRYPTOPHAN | A,B | 1VRK | 0.7 | |
TRF | N1-FORMYL-TRYPTOPHAN | A,B,C,D | 1QS7 | 0.7 | |
I3A | 1H-INDOLE-3-CARBALDEHYDE | A,B,C,D | 3BWL | 0.74 | |
I3A | 1H-INDOLE-3-CARBALDEHYDE | A,B | 2OU3 | 0.74 | |
3IL | 3-(INDOL-3-YL) LACTATE | A | 2A7P | 0.73 | |
100 | 1-(5-CHLOROINDOL-3-YL)-3-HYDROXY- 3-(2H-TETRAZOL-5-YL)-PROPENONE | A,B,C | 1QS4 | 0.91 | |
DTE | 7-CL-D-TRYPTOPHAN | A | 2V7M | 0.76 | |
4IN | 4-AMINO-L-TRYPTOPHAN | A,B | 2HXX | 0.72 | |
4IN | 4-AMINO-L-TRYPTOPHAN | A | 1OXF | 0.72 | |
2CC | 3,4-bis(7-chloro-1H-indol-3-yl)- 1H-pyrrole-2,5-dicarboxylic acid | A | 3A1L | 0.73 | |
82A | (S)-N-(1-(3-CHLORO-4-FLUOROPHENYL)- 2-HYDROXYETHYL)-4-(4-(3-CHLOROPHENYL)- 1H-PYRAZOL-3-YL)-1H-PYRROLE-2-CARBOXAMIDE | A | 2OJJ | 0.73 | |
3IB | 3-INDOLEBUTYRIC ACID | A,B | 2AY6 | 0.73 | |
3IB | 3-INDOLEBUTYRIC ACID | A,B,C,E | 2GJ6 | 0.73 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | B | 2GV2 | 0.77 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | A,B | 2AXI | 0.77 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | A,L,M | 3FEA | 0.77 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A,B | 1QPA | 0.74 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A,B | 1B80 | 0.74 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A | 1ROV | 0.74 | |
MPE | (1H-INDOL-3-YL)-(2-MERCAPTO-ETHOXYIMINO)- ACETIC ACID | A | 1M4A | 0.7 |