Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03446085
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 |
803![]() | LOVASTATIN | A,B | 1CQP | 0.73 | ![]() |
RGC![]() | REIDISPONGIOLIDE C | A | 2ASP | 0.73 | ![]() |
SIM![]() | SIMVASTATIN | A,B,C,D | 1HW9 | 0.75 | ![]() |
13T![]() | 13-DEOXYTEDANOLIDE | 0,1,3,9,A,B, C,H,J,K,L,M, N,O,Q,R,S,T, U,Y,Z | 2OTJ | 0.81 | ![]() |
20E![]() | (2beta,3beta,5beta,22R)-2,3,14,20,22,25- hexahydroxycholest-7-en-6-one | A,D | 2R40 | 0.73 | ![]() |
OVA![]() | 3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE | A | 2GZ5 | 0.74 | ![]() |
OVA![]() | 3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE | A | 1B59 | 0.74 | ![]() |
E7B![]() | A,B | 3E7B | 0.73 | ![]() | |
TG1![]() | A,B | 2AGV | 0.75 | ![]() | |
TG1![]() | A | 2ZBF | 0.75 | ![]() | |
TG1![]() | A | 2ZBG | 0.75 | ![]() | |
TG1![]() | A,B,C,D | 1WPG | 0.75 | ![]() | |
TG1![]() | A | 2C8L | 0.75 | ![]() | |
TG1![]() | A | 2EAR | 0.75 | ![]() | |
TG1![]() | A,B | 1IWO | 0.75 | ![]() | |
TG1![]() | A | 2C88 | 0.75 | ![]() | |
TG1![]() | A | 2DQS | 0.75 | ![]() | |
TG1![]() | A | 2C8K | 0.75 | ![]() | |
TG1![]() | A | 1XP5 | 0.75 | ![]() | |
TG1![]() | A | 2EAT | 0.75 | ![]() | |
PGX![]() | 7-[6-(3-HYDROPEROXY-OCT-1-ENYL)- 2,3-DIOXA-BICYCLO[2.2.1]HEPT-5- YL]-HEPT-5-ENOIC ACID | A,B,C,D | 1DDX | 0.71 | ![]() |
MVB![]() | (1S,7S,8S,8AR)-1,2,3,7,8,8A-HEXAHYDRO- 7-METHYL-8-[2-[(2R,4R)-TETRAHYDRO- 4-HY DROXY-6-OXO-2H-PYRAN-2-YL]ETHYL]- 1-NAPHTHALENOL | A,B,C | 1YA8 | 0.72 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A | 1WE2 | 0.72 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A,B | 1SFJ | 0.72 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A,B,C,D,E,F, G,H,I,J,K,L | 1GTZ | 0.72 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A | 2O7Q | 0.72 | ![]() |
DHK![]() | 3-DEHYDROSHIKIMATE | A | 2O7S | 0.72 | ![]() |
6OC![]() | (8R,9Z,12Z)-8-hydroxy-6-oxooctadeca- 9,12-dienoic acid | A,B | 2VV4 | 0.71 | ![]() |
SRN![]() | SORANGICIN A | C,D | 1YNJ | 0.7 | ![]() |
P1A![]() | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | A,D | 1R1K | 0.73 | ![]() |
P1A![]() | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | E,U | 1Z5X | 0.73 | ![]() |
P1A![]() | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | E,F,G,H | 2NXX | 0.73 | ![]() |
8PG![]() | (8S,12S)-15S-HYDROXY-9-OXOPROSTA- 10Z,13E-DIEN-1-OIC ACID | A,B | 2G5W | 0.78 | ![]() |
E4H![]() | (3R,4S,5S,7R,9E,11R,12R)-12-ETHYL- 4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC- 9-ENE-2,8-DIONE | A,B | 2HFK | 0.73 | ![]() |
GMM![]() | GLUCOSE MONOMYCOLATE | A | 1UQS | 0.73 | ![]() |
PRB![]() | 13-ACETYLPHORBOL | A | 1PTR | 0.74 | ![]() |
FA1![]() | 2,3 -ANHYDRO-QUINIC ACID | A | 1H0R | 0.71 | ![]() |
FA1![]() | 2,3 -ANHYDRO-QUINIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1GU1 | 0.71 | ![]() |
FA1![]() | 2,3 -ANHYDRO-QUINIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2C57 | 0.71 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A,B | 2IYR | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 3BAF | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 3DOO | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 1U8A | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 1ZUI | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A,B | 2EV9 | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A,B,C,D | 2HK9 | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A,B | 2D5C | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2IYQ | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2AA9 | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 1ZYU | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2GPT | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2G1K | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2AAY | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2IYX | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2DFN | 0.7 | ![]() |
SKM![]() | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID | A | 2IYS | 0.7 | ![]() |
0AS![]() | asiatic acid | A | 2QN1 | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 3C16 | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1CJU | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1TL7 | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,B | 1AB8 | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 3C14 | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1CJT | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,B,C | 1CUL | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1CJV | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 3C15 | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1U0H | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,B,C | 1CS4 | 0.71 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1CJK | 0.71 | ![]() |
PUL![]() | A | 2C78 | 0.75 | ![]() | |
114![]() | COMPACTIN | A,B,C,D | 1HW8 | 0.76 | ![]() |
LVA![]() | (3R,5R)-7-((1R,2R,6S,8R,8AS)-2,6- DIMETHYL-8-{[(2R)-2-METHYLBUTANOYL]OXY}- 1,2,6,7,8,8A-HEXAHYDRONAPHTHALEN- 1-YL)-3,5-DIHYDROXYHEPTANOIC ACID | A,B | 1T02 | 0.76 | ![]() |
PG2![]() | PROSTAGLANDIN D2 | A,B | 1RY0 | 0.78 | ![]() |
FA3![]() | 2-ANHYDRO-3-FLUORO-QUINIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1V1J | 0.7 | ![]() |
MRC![]() | MUPIROCIN | A | 1JZS | 0.74 | ![]() |
MRC![]() | MUPIROCIN | A,T | 1FFY | 0.74 | ![]() |
MRC![]() | MUPIROCIN | A | 1QU3 | 0.74 | ![]() |
MRC![]() | MUPIROCIN | A,T | 1QU2 | 0.74 | ![]() |