Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02994074
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 |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BV0 | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B,D,F,H,J,L | 1YKP | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1N8Q | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B | 2BSL | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKL | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D | 1B4U | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 3DX5 | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCA | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKN | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 1EOB | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1PHH | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BUV | 0.72 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.73 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.7 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.7 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.7 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.7 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 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 | |
3HB | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.7 | |
3HB | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.7 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.74 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.74 | |
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 | 0.7 | |
OAC | TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE | C | 3GCH | 0.73 | |
2PB | 2-[(DIOXIDOPHOSPHINO)OXY]BENZOATE | A | 1SDE | 0.78 | |
IHB | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.75 | |
1NH | (2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE | B | 1O1S | 0.74 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.72 | |
OMD | 2-(3,6-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1AJP | 0.7 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.84 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.84 | |
FHB | 3-FLUORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCF | 0.75 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.7 | |
PSN | BENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE | A | 1O4K | 0.75 | |
219 | CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE | A | 1O4I | 0.77 | |
300 | 2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE | A | 1O41 | 0.74 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1K03 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 2VQ5 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1EB9 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 2GQ9 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1Z42 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1OYB | 0.71 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.82 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.82 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.82 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.82 | |
ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.82 | |
VXX | VANILLATE | A,B | 1WB6 | 0.76 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.72 | |
262 | 2-FORMYLPHENYL DIHYDROGEN PHOSPHATE | A | 1O4D | 0.75 | |
299 | 2,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATE | A | 1O4E | 0.75 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.73 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.72 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.72 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.72 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.72 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.72 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.72 | |
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 | 0.72 | |
CP5 | (2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}- 2-PHENYLACRYLATE | A | 1SCW | 0.71 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.77 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.73 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.71 |