Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00002934
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 |
NOA![]() | NAPHTHYLOXYACETIC ACID | A,B,I | 1HIV | 0.71 | ![]() |
NOA![]() | NAPHTHYLOXYACETIC ACID | I | 1IVP | 0.71 | ![]() |
3TN![]() | (2E)-3-[4-HYDROXY-3-(3-METHOXY- 5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN- 2-YL)PHENYL]ACRYLIC ACID | A | 2P1T | 0.73 | ![]() |
MPP![]() | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.74 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.7 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.7 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.7 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.7 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.7 | ![]() |
U01![]() | 3-[1-(4-BROMO-PHENYL)-2-METHYL- PROPYL]-4-HYDROXY-CHROMEN-2-ONE | A | 1UPJ | 0.77 | ![]() |
VXX![]() | VANILLATE | A,B | 1WB6 | 0.7 | ![]() |
DBA![]() | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.76 | ![]() |
LJ4![]() | 2,6-dibromo-4-phenoxyphenol | A,B | 3CN3 | 0.71 | ![]() |
OEF![]() | 3,5-DIBROMO-4-(3-ISOPROPYL-PHENOXY)BENZOIC ACID | A | 2J4A | 0.76 | ![]() |
SXX![]() | SINAPINATE | A,B | 1WB4 | 0.74 | ![]() |
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 | ![]() |
MPB![]() | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.74 | ![]() |
MPB![]() | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.74 | ![]() |
VNL![]() | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.7 | ![]() |
VNL![]() | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.7 | ![]() |
2HC![]() | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.79 | ![]() |
LJ2![]() | 2,6-dibromo-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN1 | 0.72 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.78 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.78 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.78 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.78 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.78 | ![]() |
TOH![]() | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IME | 0.75 | ![]() |
TOH![]() | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IMD | 0.75 | ![]() |
AI7![]() | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.76 | ![]() |
PFI![]() | (6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE | A | 2HAI | 0.72 | ![]() |
TOM![]() | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.84 | ![]() |
LJ3![]() | 3,5-dibromobiphenyl-4-ol | A,B | 3CN2 | 0.71 | ![]() |
4HC![]() | 4-HYDROXY-2H-CHROMEN-2-ONE | A,B | 1V5Y | 0.78 | ![]() |
2C2![]() | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IME | 0.73 | ![]() |
2C2![]() | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IMD | 0.73 | ![]() |
OHP![]() | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.7 | ![]() |
G12![]() | 3,8-DIBROMO-7-HYDROXY-4-METHYL- 2H-CHROMEN-2-ONE | A | 2QC6 | 0.79 | ![]() |
4FE![]() | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.78 | ![]() |
HC4![]() | A | 1TS6 | 0.76 | ![]() | |
HC4![]() | A | 3PHY | 0.76 | ![]() | |
HC4![]() | A | 3PYP | 0.76 | ![]() | |
HC4![]() | A | 1T1C | 0.76 | ![]() | |
HC4![]() | A | 1OT6 | 0.76 | ![]() | |
HC4![]() | A | 1TS0 | 0.76 | ![]() | |
HC4![]() | A | 1T1A | 0.76 | ![]() | |
HC4![]() | A | 2PYP | 0.76 | ![]() | |
HC4![]() | A | 2ZOI | 0.76 | ![]() | |
HC4![]() | A | 1OTI | 0.76 | ![]() | |
HC4![]() | A | 1XFQ | 0.76 | ![]() | |
HC4![]() | A | 2D01 | 0.76 | ![]() | |
HC4![]() | A,B,C,D,E,F, G,H | 2O7B | 0.76 | ![]() | |
HC4![]() | A | 2ZOH | 0.76 | ![]() | |
HC4![]() | A | 1GSW | 0.76 | ![]() | |
HC4![]() | A | 2QJ7 | 0.76 | ![]() | |
HC4![]() | A | 1F9I | 0.76 | ![]() | |
HC4![]() | X | 1UWP | 0.76 | ![]() | |
HC4![]() | A | 2PHY | 0.76 | ![]() | |
HC4![]() | A | 1T1B | 0.76 | ![]() | |
HC4![]() | A | 1F98 | 0.76 | ![]() | |
HC4![]() | A | 1T19 | 0.76 | ![]() | |
HC4![]() | X | 1UWN | 0.76 | ![]() | |
HC4![]() | A,B,C,D,E,F, G,H | 2O7F | 0.76 | ![]() | |
HC4![]() | A | 1UGU | 0.76 | ![]() | |
HC4![]() | A | 1TS8 | 0.76 | ![]() | |
HC4![]() | A,B | 1OTD | 0.76 | ![]() | |
HC4![]() | A | 1OTE | 0.76 | ![]() | |
HC4![]() | A | 1GSX | 0.76 | ![]() | |
HC4![]() | A | 1TS7 | 0.76 | ![]() | |
HC4![]() | A | 2PYR | 0.76 | ![]() | |
HC4![]() | A | 1S4S | 0.76 | ![]() | |
HC4![]() | A | 1GSV | 0.76 | ![]() | |
HC4![]() | A | 2I9V | 0.76 | ![]() | |
HC4![]() | A | 2QWS | 0.76 | ![]() | |
HC4![]() | A | 1XFN | 0.76 | ![]() | |
HC4![]() | A | 1S4R | 0.76 | ![]() | |
HC4![]() | A | 1T18 | 0.76 | ![]() | |
HC4![]() | A | 1OTA | 0.76 | ![]() | |
HC4![]() | A | 1D7E | 0.76 | ![]() | |
HC4![]() | A | 1S1Z | 0.76 | ![]() | |
HC4![]() | A,B,C | 1MZU | 0.76 | ![]() | |
HC4![]() | A,B | 1ODV | 0.76 | ![]() | |
HC4![]() | A,B | 2J3J | 0.76 | ![]() | |
HC4![]() | A | 2QJ5 | 0.76 | ![]() | |
HC4![]() | A | 1OTB | 0.76 | ![]() | |
HC4![]() | A | 2D02 | 0.76 | ![]() | |
HC4![]() | A | 1OT9 | 0.76 | ![]() | |
HC4![]() | A | 1NWZ | 0.76 | ![]() | |
HC4![]() | A | 1S1Y | 0.76 | ![]() | |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.75 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.75 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.75 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.75 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.75 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.75 | ![]() |
BOP![]() | 1-BROMO-4-METHOXYBENZENE | C,F | 1RHQ | 0.78 | ![]() |
SN1![]() | 2,4-DIHYDROXY-TRANS CINNAMIC ACID | 1 | 1K2I | 0.74 | ![]() |
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 | ![]() |
HPP![]() | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.71 | ![]() |
HPP![]() | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.71 | ![]() |
ZZ1![]() | 4-METHYL-2H-CHROMEN-2-ONE | A | 2CIP | 0.78 | ![]() |
DHC![]() | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.71 | ![]() |
DHC![]() | CAFFEIC ACID | A | 1KOU | 0.71 | ![]() |
HOM![]() | 7-HYDROXY-4-METHYL-3-(2-HYDROXY- ETHYL)COUMARIN | C,D | 1CJF | 0.71 | ![]() |
8CM![]() | 8-HYDROXYCOUMARIN | A | 2H8Z | 0.74 | ![]() |
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 | ![]() |
FHC![]() | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.74 | ![]() |
FHC![]() | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.74 | ![]() |
FHC![]() | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.74 | ![]() |
4MU![]() | 7-hydroxy-4-methyl-2H-chromen-2- one | A,B | 3ETS | 0.75 | ![]() |
2LP![]() | 2-ALLYLPHENOL | A | 1OV5 | 0.7 | ![]() |
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 | ![]() |
COU![]() | COUMARIN | A | 3CRB | 0.78 | ![]() |
COU![]() | COUMARIN | A | 2PMJ | 0.78 | ![]() |
COU![]() | COUMARIN | A | 2H90 | 0.78 | ![]() |
COU![]() | COUMARIN | A,B,C,D | 1Z10 | 0.78 | ![]() |
COU![]() | COUMARIN | A | 2PWB | 0.78 | ![]() |
YZ9![]() | 7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER | A,B,C | 1GCZ | 0.73 | ![]() |