Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00883308
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 |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.73 |  |
| VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.73 | |
SWF | S-WARFARIN | A,B | 1OG5 | 0.71 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | A,B,C,D,I,J, K,L | 3EWF | 0.7 | |
| MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | A,B,I,L | 2V5W | 0.7 | |
| MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | B | 1VDN | 0.7 | |
| MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | C | 1VAI | 0.7 | |
3AC | (2E)-3-{3-[(5-ETHYL-3-IODO-6-METHYL- 2-OXO-1,2-DIHYDROPYRIDIN-4-YL)OXY]PHENYL}ACRYLONITRILE | A | 2B5J | 0.72 | |
8MO | METHOXSALEN | A,B,C,D | 1Z11 | 0.71 | |
VXX | VANILLATE | A,B | 1WB6 | 0.72 | |
4HC | 4-HYDROXY-2H-CHROMEN-2-ONE | A,B | 1V5Y | 0.81 | |
4MU | 7-hydroxy-4-methyl-2H-chromen-2- one | A,B | 3ETS | 0.76 | |
8CM | 8-HYDROXYCOUMARIN | A | 2H8Z | 0.87 | |
YZ9 | 7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER | A,B,C | 1GCZ | 0.76 | |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.73 | |
BRZ | 6-(1,1-DIMETHYLALLYL)-2-(1-HYDROXY- 1-METHYLETHYL)-2,3-DIHYDRO-7H-FURO[3,2- G]CHROMEN-7-ONE | C | 1K3T | 0.73 | |
HOM | 7-HYDROXY-4-METHYL-3-(2-HYDROXY- ETHYL)COUMARIN | C,D | 1CJF | 0.74 | |
SXX | SINAPINATE | A,B | 1WB4 | 0.74 | |
PFI | (6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE | A | 2HAI | 0.7 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.72 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.72 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.72 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.72 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.72 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.72 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.72 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.72 | |
KOM | 7,8-dihydroxy-4-phenyl-2H-chromen- 2-one | A | 2ZVJ | 0.76 | |
667 | 6-OXO-8,9,10,11-TETRAHYDRO-7H-CYCLOHEPTA[C][1]BENZOPYRAN- 3-O-SULFAMATE | A | 1TTM | 0.72 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.71 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.77 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.71 | |
| EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.71 | |
FX3 | 5-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop- 2-enoyl]-alpha-L-ribofuranose | A | 2VGD | 0.71 | |
300 | 2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE | A | 1O41 | 0.71 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.76 | |
U03 | 4-HYDROXY-7-METHOXY-3-(1-PHENYL- PROPYL)-CHROMEN-2-ONE | A | 3UPJ | 0.71 | |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.78 | |
MAX | MATAIRESINOL | A | 2BGM | 0.7 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.75 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.72 | |
FIL | (1E)-1-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]ETHANONE O- (AMINOCARBONYL)OXIME | A,B | 1XLZ | 0.71 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.78 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.78 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.72 | |
TRT | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.71 | |
| TRT | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.73 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.73 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.73 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.73 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.73 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.73 | |
5TN | (2E)-3-[4-HYDROXY-3-(5,5,8,8-TETRAMETHYL- 3-PROPOXY-5,6,7,8-TETRAHYDRONAPHTHALEN- 2-YL)PHENYL]ACRYLIC ACID | A | 2P1V | 0.71 | |
RWF | R-WARFARIN | A,B | 2BXD | 0.71 | |
ZZ1 | 4-METHYL-2H-CHROMEN-2-ONE | A | 2CIP | 0.84 | |
NOA | NAPHTHYLOXYACETIC ACID | A,B,I | 1HIV | 0.75 | |
| NOA | NAPHTHYLOXYACETIC ACID | I | 1IVP | 0.75 | |
MUG | 4-METHYLUMBELLIFERYL-ALPHA-D-GLUCOSE | A,B,C,D | 1CJP | 0.71 | |
4TN | (2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)-4-HYDROXYPHENYL]ACRYLIC ACID | A | 2P1U | 0.71 | |
2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IME | 0.77 | |
| 2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IMD | 0.77 | |
COU | COUMARIN | A | 3CRB | 0.86 | |
| COU | COUMARIN | A | 2PMJ | 0.86 | |
| COU | COUMARIN | A | 2H90 | 0.86 | |
| COU | COUMARIN | A,B,C,D | 1Z10 | 0.86 | |
| COU | COUMARIN | A | 2PWB | 0.86 | |
Y12 | 4-{(1E)-3-OXO-3-[(2-PHENYLETHYL)AMINO]PROP- 1-EN-1-YL}-1,2-PHENYLENE DIACETATE | A | 2EW5 | 0.73 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.75 | |
CIO | CILOMILAST | A,B | 1XOM | 0.76 | |
| CIO | CILOMILAST | A,B | 1XLX | 0.76 | |