Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02385197
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 |
HPP![]() | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.72 | ![]() |
HPP![]() | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.72 | ![]() |
OBP![]() | A,B | 2DE3 | 0.75 | ![]() | |
156![]() | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.72 | ![]() |
3CA![]() | A,B | 2B77 | 0.7 | ![]() | |
ADL![]() | (1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO- ANTHRACEN-2-YL)-ACETIC ACID | A,B | 1N5S | 0.75 | ![]() |
OAL![]() | (1,8-DIHYDROXY-9,10-DIOXO-9,10- DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID | B | 1N5T | 0.75 | ![]() |
NDD![]() | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.71 | ![]() |
NDD![]() | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.71 | ![]() |
FHB![]() | 3-FLUORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCF | 0.7 | ![]() |
3HB![]() | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.72 | ![]() |
3HB![]() | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.72 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.72 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.72 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.72 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.72 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.72 | ![]() |
4FC![]() | A | 1YSG | 0.71 | ![]() | |
HZ3![]() | dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)- 7-oxabicyclo[2.2.1]hepta-2,5-diene- 2,3-dicarboxylate | A,B | 2QR9 | 0.71 | ![]() |
1FL![]() | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.75 | ![]() |
1FL![]() | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.75 | ![]() |
G50![]() | 3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN- 1-ONE | A,B | 2UXI | 0.71 | ![]() |
EMT![]() | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B | 1KDG | 0.71 | ![]() |
EMT![]() | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B,C,D | 1O9L | 0.71 | ![]() |
ENO![]() | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.73 | ![]() |
ENO![]() | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.73 | ![]() |
ENO![]() | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.73 | ![]() |
IHB![]() | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.7 | ![]() |
HCC![]() | 2',4,4'-TRIHYDROXYCHALCONE | D | 1FP1 | 0.71 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.72 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | X | 2O48 | 0.72 | ![]() |
OHP![]() | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.7 | ![]() |
FHI![]() | A,B | 1Y1D | 0.72 | ![]() | |
159![]() | 2-HYDROXY-5-(2-MERCAPTO-ETHYLSULFAMOYL)- BENZOIC ACID | A,B | 1NME | 0.73 | ![]() |
MUF![]() | (8alpha,10alpha,13alpha,17beta)- 17-[(4-hydroxyphenyl)carbonyl]androsta- 3,5-diene-3-carboxylic acid | A,B | 3BEJ | 0.75 | ![]() |
DBE![]() | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.77 | ![]() |
AKV![]() | {3-[(1R,3S)-1,3-DIHYDROXYPENTYL]- 4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE | A,B,C,D | 2F99 | 0.71 | ![]() |
FBC![]() | A,B | 2B9A | 0.7 | ![]() | |
FLU![]() | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | L | 1FLR | 0.73 | ![]() |
FLU![]() | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A,B | 1N0S | 0.73 | ![]() |
FLU![]() | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | C,L | 1T66 | 0.73 | ![]() |
FLU![]() | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A | 1X9Q | 0.73 | ![]() |
FLU![]() | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A,D | 2NMV | 0.73 | ![]() |
JUG![]() | 5-hydroxynaphthalene-1,4-dione | A,B,C,D,E,F | 3B7J | 0.72 | ![]() |
NGV![]() | METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11- TRIOXO-3,4,6,11-TETRAHYDROTETRACENE- 1-CARBOXYLATE | A,B,C,D | 2F98 | 0.71 | ![]() |
NGV![]() | METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11- TRIOXO-3,4,6,11-TETRAHYDROTETRACENE- 1-CARBOXYLATE | A | 1SJW | 0.71 | ![]() |
TTB![]() | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.71 | ![]() |
LZ2![]() | 5-hydroxynaphthalene-1-sulfonamide | A | 2VTH | 0.7 | ![]() |
AZN![]() | ALIZARIN RED | H,I,J,K,L,M, N,O | 1OAR | 0.82 | ![]() |
26C![]() | A,B | 2F7I | 0.7 | ![]() | |
OSB![]() | 2-SUCCINYLBENZOATE | A | 1FHV | 0.73 | ![]() |
OSB![]() | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.73 | ![]() |
OSB![]() | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.73 | ![]() |
EQI![]() | EQUILIN | A,B | 1EQU | 0.71 | ![]() |
789![]() | 3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)- 1H-INDEN-1-ONE | A,B | 1ZAF | 0.73 | ![]() |
SDN![]() | [(3S)-9-hydroxy-1-methyl-10-oxo- 4,10-dihydro-3H-benzo[g]isochromen- 3-yl]acetic acid | A,B | 3B6C | 0.72 | ![]() |
BIK![]() | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5A | 0.75 | ![]() |
BIK![]() | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5C | 0.75 | ![]() |
BSP![]() | A,B | 19GS | 0.77 | ![]() | |
2E3![]() | (2E)-3-[4-hydroxy-3-(3,5,5,8,8- pentamethyl-5,6,7,8-tetrahydronaphthalen- 2-yl)phenyl]prop-2-enoic acid | A | 3FUG | 0.72 | ![]() |
886![]() | N-({4'-[(4-isobutyrylphenoxy)methyl]biphenyl- 4-yl}sulfonyl)-D-valine | A,B,C,D | 2RJP | 0.7 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.72 | ![]() |