Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00014602
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 |
HRM | 7-METHOXY-1-METHYL-9H-BETA-CARBOLINE | A | 2Z5X | 0.72 | |
HRM | 7-METHOXY-1-METHYL-9H-BETA-CARBOLINE | A | 2Z5Y | 0.72 | |
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 | |
4LG | METHYL (6-{[(2R)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)- 6-OXOPIPERAZIN-2-YL]METHOXY}-1H- INDOL-1-YL)ACETATE | A,B | 2G27 | 0.7 | |
A53 | 5-{5-[(S)-2-AMINO-3-(1H-INDOL-3- YL)-PROPOXYL]-PYRIDIN-3-YL}-3-[1- (1H-PYRROL-2-YL)-METH-(Z)-YLIDENE]- 1,3-DIHYDRO-INDOL-2-ONE | A | 2GHG | 0.71 | |
0AF | 7-hydroxy-L-tryptophan | L | 1MAE | 0.71 | |
0AF | 7-hydroxy-L-tryptophan | L | 1MAF | 0.71 | |
6EA | (1S)-1-(1H-INDOL-3-YLMETHYL)-2- (2-PYRIDIN-4-YL-[1,7]NAPHTYRIDIN- 5-YLOXY)-EHYLAMINE | E | 2F7Z | 0.72 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | B | 2GV2 | 0.71 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | A,B | 2AXI | 0.71 | |
6CW | 6-CHLORO-L-TRYPTOPHAN | A,L,M | 3FEA | 0.71 | |
SS4 | 3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2- .C.] PYRAZOLE | E | 2UZW | 0.73 | |
HRP | 5-HYDROXY-L-TRYPTOPHAN | B | 1YIA | 0.71 | |
TTQ | 6-AMINO-7-HYDROXY-L-TRYPTOPHAN | D,H | 2I0S | 0.7 | |
TTQ | 6-AMINO-7-HYDROXY-L-TRYPTOPHAN | D,H | 2HXC | 0.7 | |
991 | 2-{5-[AMINO(IMINIO)METHYL]-6-CHLORO- 1H-INDOL-2-YL}-6-(CYCLOPENTYLOXY)BENZENOLATE | A | 1O2Q | 0.7 | |
XMM | (2R,3S,4S,5S,6R)-2-(5-BROMO-4-CHLORO- 1H-INDOL-3-YLOXY)-TETRAHYDRO-6- (HYDROXYMETHYL)-2H-PYRAN-3,4,5- TRIOL | A,B,C,D | 2JE9 | 0.84 | |
XMM | (2R,3S,4S,5S,6R)-2-(5-BROMO-4-CHLORO- 1H-INDOL-3-YLOXY)-TETRAHYDRO-6- (HYDROXYMETHYL)-2H-PYRAN-3,4,5- TRIOL | A,B,C,D | 2JEC | 0.84 | |
XMM | (2R,3S,4S,5S,6R)-2-(5-BROMO-4-CHLORO- 1H-INDOL-3-YLOXY)-TETRAHYDRO-6- (HYDROXYMETHYL)-2H-PYRAN-3,4,5- TRIOL | A,B | 1ZGS | 0.84 | |
XMM | (2R,3S,4S,5S,6R)-2-(5-BROMO-4-CHLORO- 1H-INDOL-3-YLOXY)-TETRAHYDRO-6- (HYDROXYMETHYL)-2H-PYRAN-3,4,5- TRIOL | A | 2JE7 | 0.84 | |
XMM | (2R,3S,4S,5S,6R)-2-(5-BROMO-4-CHLORO- 1H-INDOL-3-YLOXY)-TETRAHYDRO-6- (HYDROXYMETHYL)-2H-PYRAN-3,4,5- TRIOL | A | 2JDZ | 0.84 | |
LX2 | [4-(3-{[2-chloro-3-(trifluoromethyl)benzyl](2,2- diphenylethyl)amino}propoxy)-1H- indol-1-yl]acetic acid | A,B,C,D | 3FC6 | 0.71 | |
ET0 | 3-(5-methoxy-1H-indol-3-yl)propanoic acid | A,B | 3ET0 | 0.76 | |
4EA | (1S)-2-(1H-INDOL-3-YL)-1-[({5-[(E)- 2-PYRIDIN-4-YLVINYL]PYRIDIN-3-YL}OXY)METHYL]ETHYLAMINE | E | 2F7X | 0.75 | |
IOS | 3-SULFOOXY-1H-INDOLE | A,B | 2BXH | 0.75 | |
P13 | N-[2-(3-AMINOPROPOXY)-5-(1H-INDOL- 5-YL)BENZYL]-N-(2-PIPERAZIN-1-YLETHYL)AMINE | B | 1UTS | 0.71 | |
ML1 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide | A,B | 2QX4 | 0.74 | |
ML1 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide | A,B | 2QX6 | 0.74 | |
ML1 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide | A,B | 2QWX | 0.74 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RU9 | 0.71 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUM | 0.71 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUL | 0.71 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUA | 0.71 |