Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02365929
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 |
CBB | 1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE- 2-CARBOXYLIC ACID 3-CARBAMIMIDOYL- BENZYLESTER | B | 1LPK | 0.71 | |
DTR | D-TRYPTOPHAN | A,B,C,D | 2R3C | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1XY8 | 0.78 | |
DTR | D-TRYPTOPHAN | A,B,C,H,K,L | 2R5D | 0.78 | |
DTR | D-TRYPTOPHAN | A | 2V7K | 0.78 | |
DTR | D-TRYPTOPHAN | A,D | 1CZQ | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1DFY | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1XY5 | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1NXN | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1TKF | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1YL9 | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1XXZ | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1XY4 | 0.78 | |
DTR | D-TRYPTOPHAN | A,D | 2Q3I | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1QFB | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1DFZ | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1XY9 | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1XY6 | 0.78 | |
DTR | D-TRYPTOPHAN | A | 2SOC | 0.78 | |
DTR | D-TRYPTOPHAN | A | 2JUE | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1SOC | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1YL8 | 0.78 | |
DTR | D-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.78 | |
DTR | D-TRYPTOPHAN | A,B | 2Q33 | 0.78 | |
DTR | D-TRYPTOPHAN | A | 1DG0 | 0.78 | |
DTR | D-TRYPTOPHAN | A,B,C,H,K,L | 2R5B | 0.78 | |
ICO | 1H-INDOLE-3-CARBOXYLIC ACID | L | 2PIP | 0.75 | |
OAI | 6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACID | A | 1C83 | 0.7 | |
9CA | 9H-CARBAZOLE | A,B,C,D,E,F | 2DE7 | 0.72 | |
PAT | ALPHA-PHOSPHONO-TRYPTOPHAN | A,B | 1I73 | 0.75 | |
IQA | (5-OXO-5,6-DIHYDRO-INDOLO[1,2-A]QUINAZOLIN- 7-YL)-ACETIC ACID | A | 1OM1 | 0.71 | |
RSS | 5-METHYL-3-(9-OXO-1,8-DIAZA-TRICYCLO[10.6.1.013,18]NONADECA- 12(19),13,15,17-TETRAEN-10-YLCARBAMOYL)- HEXANOIC ACID | A,B | 1MMP | 0.7 | |
4FW | 4-FLUOROTRYPTOPHANE | A | 1RM9 | 0.77 | |
IAV | N-[1H-INDOL-3-YL-ACETYL]VALINE ACID | A,B | 1K7F | 0.74 | |
CRR | 3,4-DI-1H-INDOL-3-YL-1H-PYRROLE- 2,5-DICARBOXYLIC ACID | A | 2Z3U | 0.71 | |
FTR | FLUOROTRYPTOPHANE | A | 2JT8 | 0.77 | |
FTR | FLUOROTRYPTOPHANE | A,B | 1NF0 | 0.77 | |
FTR | FLUOROTRYPTOPHANE | A | 2JTZ | 0.77 | |
FTR | FLUOROTRYPTOPHANE | A,B | 1I45 | 0.77 | |
FTR | FLUOROTRYPTOPHANE | A,B | 2ZNX | 0.77 | |
FTR | FLUOROTRYPTOPHANE | A,B | 1NEY | 0.77 | |
FTR | FLUOROTRYPTOPHANE | A,B | 5FWG | 0.77 | |
IOP | INDOLYLPROPIONIC ACID | A,B | 1AHF | 0.8 | |
IOP | INDOLYLPROPIONIC ACID | A | 2OLI | 0.8 | |
IOP | INDOLYLPROPIONIC ACID | A,B | 2AY5 | 0.8 | |
IPL | INDOLE-3-PROPANOL PHOSPHATE | A,B | 1BEU | 0.72 | |
IPL | INDOLE-3-PROPANOL PHOSPHATE | A,B | 1QOP | 0.72 | |
IPL | INDOLE-3-PROPANOL PHOSPHATE | A,B | 2TRS | 0.72 | |
IPL | INDOLE-3-PROPANOL PHOSPHATE | A | 1WXJ | 0.72 | |
IPL | INDOLE-3-PROPANOL PHOSPHATE | A,B | 1KFC | 0.72 | |
VX3 | 2,3-diphenyl-1H-indole-7-carboxylic acid | A | 3BGZ | 0.73 | |
3IL | 3-(INDOL-3-YL) LACTATE | A | 2A7P | 0.79 | |
IAC | 1H-INDOL-3-YLACETIC ACID | B | 2P1Q | 0.84 | |
IAC | 1H-INDOL-3-YLACETIC ACID | A | 2OYF | 0.84 | |
IAC | 1H-INDOL-3-YLACETIC ACID | A,B | 3FVU | 0.84 | |
IAC | 1H-INDOL-3-YLACETIC ACID | B | 2P1P | 0.84 | |
IAD | N-[1H-INDOL-3-YL-ACETYL]ASPARTIC ACID | A,B | 1K3U | 0.72 | |
I3N | 1-BENZYL-5-METHOXY-2-METHYL-1H- INDOL-3-YL)-ACETIC ACID | A | 1DCY | 0.73 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RU9 | 0.73 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUM | 0.73 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUL | 0.73 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUA | 0.73 | |
FIC | 5-fluoroindole-2-carboxylic acid | A,B | 3DWS | 0.77 | |
TRX | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L,M | 1K83 | 0.72 | |
TRX | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L, M,T | 2VUM | 0.72 | |
TRX | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L,M | 3CQZ | 0.72 | |
KAW | N-{(5S)-4,4-dihydroxy-6-phenyl- 5-[(phenylcarbonyl)amino]hexanoyl}- L-tryptophan | A | 3BKL | 0.71 | |
I3A | 1H-INDOLE-3-CARBALDEHYDE | A,B,C,D | 3BWL | 0.71 | |
I3A | 1H-INDOLE-3-CARBALDEHYDE | A,B | 2OU3 | 0.71 | |
2MI | 2-METHYL-1H-INDOLE | A | 2PIO | 0.73 | |
IDA | (2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO- INDOL-7-YL)ACETIC ACID | A,B | 1OXL | 0.82 | |
IAG | N-[1H-INDOL-3-YL-ACETYL]GLYCINE ACID | A,B | 1K8Z | 0.75 | |
IAG | N-[1H-INDOL-3-YL-ACETYL]GLYCINE ACID | A,B | 1K7E | 0.75 | |
2S8 | (2S)-8-[(tert-butoxycarbonyl)amino]- 2-(1H-indol-3-yl)octanoic acid | B | 3C6N | 0.8 | |
TTR | 9-ACETYL-2,3,4,9-TETRAHYDRO-1H- CARBAZOL-1-ONE | A | 2D82 | 0.71 | |
MRX | 5-bromo-3-(pyrrolidin-1-ylsulfonyl)- 1H-indole-2-carboxamide | A | 2RF2 | 0.74 | |
SU1 | 3-[(3-(2-CARBOXYETHYL)-4-METHYLPYRROL- 2-YL)METHYLENE]-2-INDOLINONE | A,B | 1FGI | 0.74 | |
CLI | 3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID | A,F | 1LEV | 0.73 | |
CRZ | 4-(9H-CARBAZOL-9-YL)BUTANOIC ACID | A | 1TOW | 0.72 | |
ET0 | 3-(5-methoxy-1H-indol-3-yl)propanoic acid | A,B | 3ET0 | 0.74 | |
IOK | N-[(1R)-3-(4-HYDROXYPHENYL)-1-METHYLPROPYL]- 2-(2-PHENYL-1H-INDOL-3-YL)ACETAMIDE | A,B | 2IOK | 0.72 | |
4IN | 4-AMINO-L-TRYPTOPHAN | A,B | 2HXX | 0.76 | |
4IN | 4-AMINO-L-TRYPTOPHAN | A | 1OXF | 0.76 | |
DTE | 7-CL-D-TRYPTOPHAN | A | 2V7M | 0.72 | |
ATU | 9-NITRO-5,12-DIHYDRO-7H-BENZO[2,3]AZEPINO[4,5- B]INDOL-6-ONE | A,B | 1Q3W | 0.72 | |
TSR | 2-(1H-INDOL-3-YL)ACETAMIDE | D,H | 2OJY | 0.76 | |
TSR | 2-(1H-INDOL-3-YL)ACETAMIDE | A,D,H | 2OIZ | 0.76 | |
UP3 | A | 3D8N | 0.73 | ||
2S3 | (2S)-2-(1H-indol-3-yl)pentanoic acid | B | 3C6P | 0.84 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | B | 2GV2 | 0.73 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | A,B | 2AXI | 0.73 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | A,L,M | 3FEA | 0.73 | |
TRO | 2-HYDROXY-TRYPTOPHAN | A | 1KB0 | 0.77 | |
TRO | 2-HYDROXY-TRYPTOPHAN | A | 1G3P | 0.77 | |
6IN | 4-(1-BENZYL-3-CARBAMOYLMETHYL-2- METHYL-1H-INDOL-5-YLOXY)-BUTYRIC ACID | A | 1DB5 | 0.71 | |
PDS | 3-{1-[3-(DIMETHYLAMINO)PROPYL]- 2-METHYL-1H-INDOL-3-YL}-4-(2-METHYL- 1H-INDOL-3-YL)-1H-PYRROLE-2,5-DIONE | A,B | 2I0E | 0.71 | |
TCR | CYCLOMETHYLTRYPTOPHAN | A | 3AIG | 0.79 | |
2S2 | (2S)-2-(1H-indol-3-yl)hexanoic acid | B | 3C6O | 0.84 | |
678 | (3-{5-[AMINO(IMINIO)METHYL]-1H- INDOL-2-YL}-5-BROMO-4-OXIDOPHENYL)ACETATE | A | 1O3L | 0.79 | |
TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AH0 | 0.74 | |
TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AGZ | 0.74 | |
HRP | 5-HYDROXY-L-TRYPTOPHAN | B | 1YIA | 0.73 | |
FIP | 5-FLUOROINDOLE PROPANOL PHOSPHATE | A,B | 1FUY | 0.7 | |
FIP | 5-FLUOROINDOLE PROPANOL PHOSPHATE | A,B | 1A50 | 0.7 | |
FIP | 5-FLUOROINDOLE PROPANOL PHOSPHATE | A,B | 1A5S | 0.7 | |
3IB | 3-INDOLEBUTYRIC ACID | A,B | 2AY6 | 0.78 | |
3IB | 3-INDOLEBUTYRIC ACID | A,B,C,E | 2GJ6 | 0.78 | |
ITR | IMINO-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.79 | |
BTR | 6-BROMO-TRYPTOPHAN | A | 1WCT | 0.82 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A,B | 1QPA | 0.75 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A,B | 1B80 | 0.75 | |
HTR | BETA-HYDROXYTRYPTOPHANE | A | 1ROV | 0.75 | |
907 | 2-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-6-BROMO-4-METHYLBENZENOLATE | A | 1O3I | 0.74 | |
907 | 2-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-6-BROMO-4-METHYLBENZENOLATE | A | 1O3H | 0.74 | |
FT6 | 6-FLUORO-L-TRYPTOPHAN | A,B | 2NW9 | 0.77 | |
TRF | N1-FORMYL-TRYPTOPHAN | A,B | 1VRK | 0.74 | |
TRF | N1-FORMYL-TRYPTOPHAN | A,B,C,D | 1QS7 | 0.74 | |
3IO | 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID | A,B,C,D | 1XES | 0.8 | |
3IO | 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID | B,C,D | 1XET | 0.8 | |
PP9 | PROTOPORPHYRIN IX | A | 1Z53 | 0.72 | |
PP9 | PROTOPORPHYRIN IX | A,B,C,D | 2HRE | 0.72 | |
PP9 | PROTOPORPHYRIN IX | A,B | 2QD5 | 0.72 | |
PP9 | PROTOPORPHYRIN IX | A | 1HRS | 0.72 | |
PP9 | PROTOPORPHYRIN IX | A,B,C,D | 2QD1 | 0.72 | |
TPL | TRYPTOPHANOL | A | 1EE7 | 0.71 | |
CTE | 7-CHLOROTRYPTOPHAN | A | 2AR8 | 0.72 | |
CTE | 7-CHLOROTRYPTOPHAN | A | 2V7L | 0.72 | |
ML2 | N-[2-(2-iodo-5-methoxy-1H-indol- 3-yl)ethyl]acetamide | A,B | 2QX9 | 0.7 | |
ML2 | N-[2-(2-iodo-5-methoxy-1H-indol- 3-yl)ethyl]acetamide | A,B | 2QX8 | 0.7 | |
LTN | L-TRYPTOPHANAMIDE | A | 1MAU | 0.73 | |
LTN | L-TRYPTOPHANAMIDE | A,B | 2QUI | 0.73 | |
MPE | (1H-INDOL-3-YL)-(2-MERCAPTO-ETHOXYIMINO)- ACETIC ACID | A | 1M4A | 0.78 |