Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03465038
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 | 0.76 |  |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.71 | |
3HB | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.72 | |
| 3HB | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.72 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.74 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.74 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.74 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.74 | |
| ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.74 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.72 | |
| 1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.72 | |
2HI | (2S,3R)-2,7-DIHYDROXY-3-(4-HYDROXYPHENYL)- 2,3-DIHYDRO-4H-CHROMEN-4-ONE | A | 1ZG3 | 0.71 | |
AJA | (6AR,10AR)-3-(1,1-DIMETHYLHEPTYL)- 1-HYDROXY-6,6-DIMETHYL-6A,7,10,10A- TETRAHYDRO-6H-BENZO[C]CHROMENE- 9-CARBOXYLIC ACID | A,B,C,D | 2OM9 | 0.72 | |
ADL | (1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO- ANTHRACEN-2-YL)-ACETIC ACID | A,B | 1N5S | 0.78 | |
34D | 3,5-DIHYDROXYBENZOATE | A,B | 2BX7 | 0.73 | |
CPH | 1,8-DIHYDROXY-7-METHYL-3-(1,3,4- TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO- 2H-ANTHRACEN-9-ONE | A,B | 1D83 | 0.8 | |
| CPH | 1,8-DIHYDROXY-7-METHYL-3-(1,3,4- TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO- 2H-ANTHRACEN-9-ONE | A,B | 1EKH | 0.8 | |
| CPH | 1,8-DIHYDROXY-7-METHYL-3-(1,3,4- TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO- 2H-ANTHRACEN-9-ONE | A,B | 1EKI | 0.8 | |
| CPH | 1,8-DIHYDROXY-7-METHYL-3-(1,3,4- TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO- 2H-ANTHRACEN-9-ONE | A,B,C,D | 1VAQ | 0.8 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.76 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.76 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.76 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.76 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.76 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.76 | |
DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3CMP | 0.73 | |
| DBH | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MD9 | 0.73 | |
| DBH | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MDB | 0.73 | |
| DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 1L6M | 0.73 | |
| DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3BY0 | 0.73 | |
113 | 7,8-DIHYDROXY-1-METHOXY-3-METHYL- 10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3- B]CHROMENE-9-CARBOXYLIC ACID | A,B | 1KR3 | 0.71 | |
| 113 | 7,8-DIHYDROXY-1-METHOXY-3-METHYL- 10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3- B]CHROMENE-9-CARBOXYLIC ACID | A,B | 1HLK | 0.71 | |
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 | 0.74 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.71 | |
| AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.71 | |
AKV | {3-[(1R,3S)-1,3-DIHYDROXYPENTYL]- 4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE | A,B,C,D | 2F99 | 0.8 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.72 | |
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5A | 0.75 | |
| BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5C | 0.75 | |
CRH | 1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1- METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)- 8,9-DIHYROXY-7-METHYLANTHRACENE | A,B | 146D | 0.7 | |
| CRH | 1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1- METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)- 8,9-DIHYROXY-7-METHYLANTHRACENE | A,B | 207D | 0.7 | |
23A | 2,3-DIHYDROXYBENZALDEHYDE | A,B,C,D | 2DVX | 0.71 | |