Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03412587
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 |
AGI![]() | 5,7-dihydroxy-2-(4-hydroxyphenyl)- 4H-chromen-4-one | A,B,C,D,E,F | 3CF9 | 0.71 | ![]() |
A15![]() | 3'-3"-DICHLOROPHENOL-1,8-3H-BENZO[DE]ISOCHROMEN- 1-ONE | A | 1TSL | 0.7 | ![]() |
P2N![]() | (5Z)-13-CHLORO-14,16-DIHYDROXY- 3,4,7,8,9,10-HEXAHYDRO-1H-2-BENZOXACYCLOTETRADECINE- 1,11(12H)-DIONE | A | 2CGF | 0.84 | ![]() |
L1O![]() | 4-(2-aminoethoxy)-3,5-dichlorobenzoic acid | A | 2VIO | 0.74 | ![]() |
C2U![]() | 3,5-dichloro-2-hydroxybenzoic acid | A | 3C3U | 0.75 | ![]() |
C2U![]() | 3,5-dichloro-2-hydroxybenzoic acid | A | 3CV7 | 0.75 | ![]() |
CHB![]() | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.71 | ![]() |
NP4![]() | (5Z)-12-CHLORO-13,15-DIHYDROXY- 4,7,8,9-TETRAHYDRO-2-BENZOXACYCLOTRIDECINE- 1,10(3H,11H)-DIONE | A | 2IWS | 0.84 | ![]() |
MOA![]() | MYCOPHENOLIC ACID | A | 1ME7 | 0.77 | ![]() |
MOA![]() | MYCOPHENOLIC ACID | A,B | 1JR1 | 0.77 | ![]() |
MOA![]() | MYCOPHENOLIC ACID | A | 1MEI | 0.77 | ![]() |
MOA![]() | MYCOPHENOLIC ACID | A | 1MEH | 0.77 | ![]() |
3CA![]() | A,B | 2B77 | 0.73 | ![]() | |
HMY![]() | (1aR,8S,13S,14S,15aR)-5,13,14-trihydroxy- 3-methoxy-8-methyl-8,9,13,14,15,15a- hexahydro-6H-oxireno[k][2]benzoxacyclotetradecine- 6,12(1aH)-dione | A,B | 3C9W | 0.73 | ![]() |
HIB![]() | 4-HYDROXY-5-IODO-2,3-DIMETHOXY- 6-METHYLBENZOIC ACID | A | 2PIK | 0.8 | ![]() |
QSO![]() | 5,7-dihydroxy-3-(4-methoxyphenyl)- 4H-chromen-4-one | A,B | 2QYO | 0.72 | ![]() |
IH5![]() | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAV | 0.74 | ![]() |
IH5![]() | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAX | 0.74 | ![]() |
BVL![]() | (2E)-1-[2-hydroxy-4-methoxy-5-(3- methylbut-2-en-1-yl)phenyl]-3-(4- hydroxyphenyl)prop-2-en-1-one | A | 2ZBH | 0.73 | ![]() |
NP5![]() | (5E)-12-CHLORO-13,15-DIHYDROXY- 4,7,8,9-TETRAHYDRO-2-BENZOXACYCLOTRIDECINE- 1,10(3H,11H)-DIONE | A | 2IWU | 0.84 | ![]() |
FRR![]() | (3R,5Z,8S,9S,11E)-8,9,16-TRIHYDROXY- 14-METHOXY-3-METHYL-3,4,9,10-TETRAHYDRO- 1H-2-BENZOXACYCLOTETRADECINE-1,7(8H)- DIONE | A | 2E14 | 0.76 | ![]() |
MGI![]() | methyl 4-(2,3-dihydroxy-5-methylphenoxy)- 2-hydroxy-6-methylbenzoate | A | 2ZA0 | 0.75 | ![]() |
GEN![]() | GENISTEIN | A | 1QKM | 0.72 | ![]() |
GEN![]() | GENISTEIN | A,B | 1X7J | 0.72 | ![]() |
GEN![]() | GENISTEIN | A,B | 2QA8 | 0.72 | ![]() |
GEN![]() | GENISTEIN | A | 1X7R | 0.72 | ![]() |
RDC![]() | RADICICOL | A,B | 2Q8I | 0.82 | ![]() |
RDC![]() | RADICICOL | A,B | 1U0Z | 0.82 | ![]() |
RDC![]() | RADICICOL | A | 1BGQ | 0.82 | ![]() |
RDC![]() | RADICICOL | B,D,F,H | 2ZBK | 0.82 | ![]() |
RDC![]() | RADICICOL | A | 2HKJ | 0.82 | ![]() |
RDC![]() | RADICICOL | A,B,C | 3CGY | 0.82 | ![]() |
RDC![]() | RADICICOL | A,B | 2WER | 0.82 | ![]() |
HMO![]() | 4'-HYDROXY-7-METHOXYISOFLAVONE | A | 1FP2 | 0.72 | ![]() |
NCZ![]() | 2-HYDROXY-7-METHOXY-5-METHYL-NAPHTHALENE- 1-CARBOXYLIC ACID MESO-2,5-DIHYDROXY- CYCLOPENT-3-ENYL ESTER | A | 1J5I | 0.71 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.71 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.71 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.71 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.71 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.71 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 3DGQ | 0.72 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 11GS | 0.72 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B,C,D | 1GSF | 0.72 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 2GSS | 0.72 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 3GSS | 0.72 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 1GSE | 0.72 | ![]() |
M1S![]() | (5E)-14-CHLORO-15,17-DIHYDROXY- 4,7,8,9,10,11-HEXAHYDRO-2-BENZOXACYCLOPENTADECINE- 1,12(3H,13H)-DIONE | A | 2IWX | 0.84 | ![]() |
SAK![]() | (2S)-5-hydroxy-2-(4-hydroxyphenyl)- 7-methoxy-2,3-dihydro-4H-chromen- 4-one | A,B,C,D,E,F | 3D04 | 0.7 | ![]() |
SYR![]() | SYRINGATE | A,B | 1WB5 | 0.73 | ![]() |
34C![]() | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.72 | ![]() |