Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00579714
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 |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.74 |  |
SWF | S-WARFARIN | A,B | 1OG5 | 0.71 | |
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 | 0.72 | |
DFL | 2-(4-HYDROXY-PHENYL)-CHROMAN-4- ONE | A,B | 1JEP | 0.71 | |
8MO | METHOXSALEN | A,B,C,D | 1Z11 | 0.71 | |
FC3 | 5-[2-(TRIFLUOROMETHYL)PHENYL]-2- FUROIC ACID | A | 2EVC | 0.73 | |
VXX | VANILLATE | A,B | 1WB6 | 0.7 | |
NRO | 3-[5-(2-nitropent-1-en-1-yl)furan- 2-yl]benzoic acid | A,B | 2ZK5 | 0.7 | |
DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A | 2Z9C | 0.74 | |
| DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A,B | 1OOQ | 0.74 | |
| DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A,B,C,D,E,F, G,H | 2F1O | 0.74 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.7 | |
| VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.7 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.72 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.72 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.72 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.72 | |
| ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.72 | |
DBF | DIBENZOFURAN-4,6-DICARBOXYLIC ACID | B | 1DVU | 0.76 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.71 | |
| EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.71 | |
PFI | (6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE | A | 2HAI | 0.72 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.81 | |
CA2 | (1S,3R,4R,5S)-1,3,4-TRIHYDROXY- 5-(3-PHENOXYPROPYL)CYCLOHEXANECARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2BT4 | 0.71 | |
300 | 2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE | A | 1O41 | 0.71 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | L | 1FLR | 0.71 | |
| FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A,B | 1N0S | 0.71 | |
| FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | C,L | 1T66 | 0.71 | |
| FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A | 1X9Q | 0.71 | |
| FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A,D | 2NMV | 0.71 | |
PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A,B | 1FHY | 0.73 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | B | 204D | 0.73 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A,B | 2B2B | 0.73 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | B | 1FHZ | 0.73 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A | 203D | 0.73 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.71 | |
NOM | 7-HYDROXY-5-METHYL-3,3A,5,11B-TETRAHYDRO- 1,4-DIOXA-CYCLOPENTA[A]ANTHRACENE- 2,6,11-TRIONE | A | 1N5V | 0.72 | |
ODE | DIETHYL (1R,2S,3R,4S)-5,6-BIS(4- HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT- 5-ENE-2,3-DICARBOXYLATE | A,B | 2QH6 | 0.74 | |
C1F | 3-CARBOXY-4-METHYL-5-PROPYL-2-FURANPROPIONIC | A,B | 2BXA | 0.83 | |
MAX | MATAIRESINOL | A | 2BGM | 0.72 | |
VII | 2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID | A,B | 2GFK | 0.83 | |
KWT | (1S,6BR,9AS,11R,11BR)-9A,11B-DIMETHYL- 1-[(METHYLOXY)METHYL]-3,6,9-TRIOXO- 1,6,6B,7,8,9,9A,10,11,11B-DECAHYDRO- 3H-FURO[4,3,2-DE]INDENO[4,5-H][2]BENZOPYRAN- 11-YL ACETATE | A | 3D5X | 0.75 | |
| KWT | (1S,6BR,9AS,11R,11BR)-9A,11B-DIMETHYL- 1-[(METHYLOXY)METHYL]-3,6,9-TRIOXO- 1,6,6B,7,8,9,9A,10,11,11B-DECAHYDRO- 3H-FURO[4,3,2-DE]INDENO[4,5-H][2]BENZOPYRAN- 11-YL ACETATE | A | 1E7U | 0.75 | |
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 | 0.71 | |
RWF | R-WARFARIN | A,B | 2BXD | 0.71 | |
BZF | BENZOFURAN | A | 182L | 0.75 | |
BYS | 2-BENZO[1,3]DIOXOL-5-YLMETHYL-3- BENZYL-SUCCINIC ACID | A,B | 1JJE | 0.71 | |
L41 | {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid | A,B | 3D5F | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.77 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.77 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.77 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.77 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.77 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.77 | |
A04 | 5-[2-(TRIFLUOROMETHOXY)PHENYL]- 2-FUROIC ACID | A | 2Q94 | 0.72 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.76 | |
MOF | MOMETASONE FUROATE | A,B | 1SR7 | 0.72 | |
GW6 | (6alpha,11alpha,14beta,16alpha,17alpha)- 6,9-difluoro-17-{[(fluoromethyl)sulfanyl]carbonyl}- 11-hydroxy-16-methyl-3-oxoandrosta- 1,4-dien-17-yl furan-2-carboxylate | A,B | 3CLD | 0.72 | |
MOA | MYCOPHENOLIC ACID | A | 1ME7 | 0.71 | |
| MOA | MYCOPHENOLIC ACID | A,B | 1JR1 | 0.71 | |
| MOA | MYCOPHENOLIC ACID | A | 1MEI | 0.71 | |
| MOA | MYCOPHENOLIC ACID | A | 1MEH | 0.71 | |