Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02546289
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 |
174![]() | 4-CHLORO-BENZOIC ACID | X | 3DLP | 0.77 | ![]() |
174![]() | 4-CHLORO-BENZOIC ACID | X | 1T5D | 0.77 | ![]() |
C2U![]() | 3,5-dichloro-2-hydroxybenzoic acid | A | 3C3U | 0.84 | ![]() |
C2U![]() | 3,5-dichloro-2-hydroxybenzoic acid | A | 3CV7 | 0.84 | ![]() |
OHP![]() | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.71 | ![]() |
HBA![]() | P-HYDROXYBENZALDEHYDE | A | 1K03 | 0.78 | ![]() |
HBA![]() | P-HYDROXYBENZALDEHYDE | A,B | 2VQ5 | 0.78 | ![]() |
HBA![]() | P-HYDROXYBENZALDEHYDE | A,B | 1EB9 | 0.78 | ![]() |
HBA![]() | P-HYDROXYBENZALDEHYDE | A | 2GQ9 | 0.78 | ![]() |
HBA![]() | P-HYDROXYBENZALDEHYDE | A,B | 1Z42 | 0.78 | ![]() |
HBA![]() | P-HYDROXYBENZALDEHYDE | A | 1OYB | 0.78 | ![]() |
BP6![]() | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.7 | ![]() |
DOB![]() | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOD | 0.73 | ![]() |
DOB![]() | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOE | 0.73 | ![]() |
DOB![]() | 2,4-DIHYDROXYBENZOIC ACID | A | 1PBB | 0.73 | ![]() |
DBE![]() | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.71 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.78 | ![]() |
SAL![]() | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.78 | ![]() |
GRE![]() | 2,6-DIHYDROXYBENZOIC ACID | A,B,C,D | 2DVU | 0.75 | ![]() |
G50![]() | 3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN- 1-ONE | A,B | 2UXI | 0.71 | ![]() |
PSN![]() | BENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE | A | 1O4K | 0.74 | ![]() |
DIU![]() | 2-HYDROXY-3,5-DIIODO-BENZOIC ACID | A,B | 3B56 | 0.75 | ![]() |
DIU![]() | 2-HYDROXY-3,5-DIIODO-BENZOIC ACID | A | 2BXL | 0.75 | ![]() |
43M![]() | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.72 | ![]() |
3BZ![]() | 3-chlorobenzoate | X | 2QVZ | 0.75 | ![]() |
3BZ![]() | 3-chlorobenzoate | X | 2QVX | 0.75 | ![]() |
3HB![]() | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.73 | ![]() |
3HB![]() | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.73 | ![]() |
HCC![]() | 2',4,4'-TRIHYDROXYCHALCONE | D | 1FP1 | 0.71 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.72 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | X | 2O48 | 0.72 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.73 | ![]() |
PHB![]() | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.73 | ![]() |
3CA![]() | A,B | 2B77 | 0.81 | ![]() | |
34Z![]() | 3,4-dichlorobenzoate | X | 2QVY | 0.75 | ![]() |
34Z![]() | 3,4-dichlorobenzoate | X | 2QW0 | 0.75 | ![]() |
FHB![]() | 3-FLUORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCF | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.71 | ![]() |
CHB![]() | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.78 | ![]() |
3C4![]() | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.76 | ![]() |
3C4![]() | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.76 | ![]() |
3C4![]() | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.76 | ![]() |
3C4![]() | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.76 | ![]() |
3C4![]() | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.76 | ![]() |
262![]() | 2-FORMYLPHENYL DIHYDROGEN PHOSPHATE | A | 1O4D | 0.77 | ![]() |
299![]() | 2,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATE | A | 1O4E | 0.72 | ![]() |
JUG![]() | 5-hydroxynaphthalene-1,4-dione | A,B,C,D,E,F | 3B7J | 0.73 | ![]() |
23A![]() | 2,3-DIHYDROXYBENZALDEHYDE | A,B,C,D | 2DVX | 0.79 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3CMP | 0.72 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MD9 | 0.72 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MDB | 0.72 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 1L6M | 0.72 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3BY0 | 0.72 | ![]() |
219![]() | CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE | A | 1O4I | 0.73 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.71 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.71 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.71 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.71 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.71 | ![]() |
IHB![]() | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.71 | ![]() |
2CL![]() | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IPW | 0.7 | ![]() |
2CL![]() | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IS7 | 0.7 | ![]() |