Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03519744
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 |
OVA![]() | 3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE | A | 2GZ5 | 0.78 | ![]() |
OVA![]() | 3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE | A | 1B59 | 0.78 | ![]() |
B2S![]() | (3alpha,7alpha)-3,7,15-trihydroxy- 12,13-epoxytrichothec-9-en-8-one | A | 3B2S | 0.76 | ![]() |
20E![]() | (2beta,3beta,5beta,22R)-2,3,14,20,22,25- hexahydroxycholest-7-en-6-one | A,D | 2R40 | 0.72 | ![]() |
FOK![]() | FORSKOLIN | A,C | 3C16 | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1CJU | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1TL7 | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,B | 1AB8 | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,C | 3C14 | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1CJT | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,B,C | 1CUL | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1CJV | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,C | 3C15 | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1U0H | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,B,C | 1CS4 | 0.7 | ![]() |
FOK![]() | FORSKOLIN | A,C | 1CJK | 0.7 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A,B | 1E3R | 0.71 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 3DHE | 0.71 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1J99 | 0.71 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1COY | 0.71 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1Q22 | 0.71 | ![]() |
TH2![]() | TESTOSTERONE HEMISUCCINATE | A,B | 2CBT | 0.7 | ![]() |
TH2![]() | TESTOSTERONE HEMISUCCINATE | A,B,C,D,E,F | 2CBQ | 0.7 | ![]() |
TH2![]() | TESTOSTERONE HEMISUCCINATE | A | 2CBO | 0.7 | ![]() |
C0R![]() | CORTICOSTERONE | A | 2A3I | 0.71 | ![]() |
C0R![]() | CORTICOSTERONE | A,B | 1Y5R | 0.71 | ![]() |
MOU![]() | A,B | 2NPF | 0.74 | ![]() | |
DEX![]() | DEXAMETHASONE | A,D | 1M2Z | 0.71 | ![]() |
DEX![]() | DEXAMETHASONE | A,B,C,D | 1P93 | 0.71 | ![]() |
GR4![]() | H,I | 1AWF | 0.74 | ![]() | |
0AS![]() | asiatic acid | A | 2QN1 | 0.72 | ![]() |
WIN![]() | methyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)- 15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}- 3,11,12-trihydroxy-2,16-dioxo-13,20- epoxypicras-3-en-21-oate | 0,1,2,3,9,A, B,C,F,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 3G71 | 0.71 | ![]() |
1CA![]() | DESOXYCORTICOSTERONE | A,B | 1Y9R | 0.71 | ![]() |
1CA![]() | DESOXYCORTICOSTERONE | A,B,C | 2ABI | 0.71 | ![]() |
1CA![]() | DESOXYCORTICOSTERONE | A | 2Q3Y | 0.71 | ![]() |
1CA![]() | DESOXYCORTICOSTERONE | A | 2AA7 | 0.71 | ![]() |
HCY![]() | (11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione | A,B | 2VDY | 0.74 | ![]() |
HCY![]() | (11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione | A | 2V95 | 0.74 | ![]() |
SXN![]() | Salinixanthin | A,B | 3DDL | 0.75 | ![]() |
PLO![]() | (3BETA)-3-HYDROXYPREGN-5-EN-20- ONE | A | 1Q20 | 0.7 | ![]() |
GMM![]() | GLUCOSE MONOMYCOLATE | A | 1UQS | 0.73 | ![]() |
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 | 0.7 | ![]() |
ZK5![]() | 9ALPHA-FLUOROCORTISOL | A | 1GS4 | 0.73 | ![]() |
SIM![]() | SIMVASTATIN | A,B,C,D | 1HW9 | 0.71 | ![]() |
ZBA![]() | 12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate | A | 2RKV | 0.73 | ![]() |
ZBA![]() | 12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate | A,B,C,D | 2ZBA | 0.73 | ![]() |
P1A![]() | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | A,D | 1R1K | 0.72 | ![]() |
P1A![]() | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | E,U | 1Z5X | 0.72 | ![]() |
P1A![]() | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | E,F,G,H | 2NXX | 0.72 | ![]() |
NTH![]() | SUCCINIC ACID MONO-(13-METHYL-3- OXO-2,3,6,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 17-YL) ESTER | A,B | 1BUQ | 0.71 | ![]() |
PRB![]() | 13-ACETYLPHORBOL | A | 1PTR | 0.77 | ![]() |