Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00998792
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 |
TUO | 2-(hydrazinocarbonyl)-3-phenyl- 1H-indole-5-sulfonamide | A | 3B4F | 0.72 | |
IID | N-(1-ISOPROPYLPIPERIDIN-4-YL)-1- (3-METHOXYBENZYL)-1H-INDOLE-2-CARBOXAMIDE | A,B | 2BQ7 | 0.71 | |
V25 | ethyl 3-[(E)-2-amino-1-cyanoethenyl]- 6,7-dichloro-1-methyl-1H-indole- 2-carboxylate | A | 2VAG | 0.71 | |
SF1 | 1-BENZYL-5-CHLORO-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID | A,B | 2Q61 | 0.81 | |
SF2 | 5-CHLORO-1-(3-METHOXYBENZYL)-3- (PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID | A,B | 2Q6R | 0.78 | |
669 | 1-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)- 1H-INDOLE-2-CARBOXYLIC ACID | A | 1MZS | 0.7 | |
ET0 | 3-(5-methoxy-1H-indol-3-yl)propanoic acid | A,B | 3ET0 | 0.7 | |
OAI | 6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACID | A | 1C83 | 0.72 | |
TRO | 2-HYDROXY-TRYPTOPHAN | A | 1KB0 | 0.71 | |
TRO | 2-HYDROXY-TRYPTOPHAN | A | 1G3P | 0.71 | |
KAW | N-{(5S)-4,4-dihydroxy-6-phenyl- 5-[(phenylcarbonyl)amino]hexanoyl}- L-tryptophan | A | 3BKL | 0.71 | |
FXN | 5-FLUORO-1H-INDOLE-2-CARBOXYLIC ACID- (2-MERCAPTO-ETHYL)-AMIDE | A,B | 1SHL | 0.7 | |
VX3 | 2,3-diphenyl-1H-indole-7-carboxylic acid | A | 3BGZ | 0.75 | |
IDA | (2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO- INDOL-7-YL)ACETIC ACID | A,B | 1OXL | 0.71 | |
2S3 | (2S)-2-(1H-indol-3-yl)pentanoic acid | B | 3C6P | 0.72 | |
TTR | 9-ACETYL-2,3,4,9-TETRAHYDRO-1H- CARBAZOL-1-ONE | A | 2D82 | 0.71 | |
CBB | 1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE- 2-CARBOXYLIC ACID 3-CARBAMIMIDOYL- BENZYLESTER | B | 1LPK | 0.8 | |
792 | N-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}- 5-methyl-D-tryptophan | A,B,C,D | 3G42 | 0.7 | |
QND | QUINALDIC ACID | A,B | 1IDA | 0.71 | |
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 | |
IMM | 1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE- 3-ACETIC ACID | A,B | 1PGF | 0.72 | |
IMM | 1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE- 3-ACETIC ACID | A,B | 1PGG | 0.72 | |
7CK | 7-carboxy-5-hydroxy-12,13-dihydro- 6H-indolo[2,3-a]pyrrolo[3,4-c]carbazole | A,B | 2R0G | 0.73 | |
A46 | 5-chloro-N-{4-[(1R)-1,2-dihydroxyethyl]phenyl}- 1H-indole-2-carboxamide | A,B | 2ZB2 | 0.74 | |
TCR | CYCLOMETHYLTRYPTOPHAN | A | 3AIG | 0.73 | |
MPE | (1H-INDOL-3-YL)-(2-MERCAPTO-ETHOXYIMINO)- ACETIC ACID | A | 1M4A | 0.71 | |
CLI | 3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID | A,F | 1LEV | 0.76 | |
NZA | 5-CHLORO-1-(4-CHLOROBENZYL)-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID | A,B | 2Q5S | 0.81 | |
CRR | 3,4-DI-1H-INDOL-3-YL-1H-PYRROLE- 2,5-DICARBOXYLIC ACID | A | 2Z3U | 0.77 | |
DSI | 4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)- 8-METHYL-3,6,7,8-TETRAHYDRO-3,6- DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER | B | 1DSI | 0.72 | |
2CC | 3,4-bis(7-chloro-1H-indol-3-yl)- 1H-pyrrole-2,5-dicarboxylic acid | A | 3A1L | 0.7 | |
ICO | 1H-INDOLE-3-CARBOXYLIC ACID | L | 2PIP | 0.71 | |
AR2 | ARGINYL-BENZOTHIAZOLE-6-CARBOXYLIC ACID | A,B,I | 1DOJ | 0.71 | |
NSI | 3-(4-METHOXYPHENYL)-N-(PHENYLSULFONYL)- 1-[3-(TRIFLUOROMETHYL)BENZYL]-1H- INDOLE-2-CARBOXAMIDE | A | 2HFP | 0.71 | |
FIC | 5-fluoroindole-2-carboxylic acid | A,B | 3DWS | 0.83 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1CQ1 | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1OTW | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1C9U | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1W6S | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1FLG | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1KV9 | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD6 | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1CRU | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1H4I | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD7 | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD8 | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,D,I | 2D0V | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 4AAH | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C,E,G | 1H4J | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1KB0 | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A | 1YIQ | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1LRW | 0.71 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1G72 | 0.71 | |
I3N | 1-BENZYL-5-METHOXY-2-METHYL-1H- INDOL-3-YL)-ACETIC ACID | A | 1DCY | 0.71 |