Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03367092
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 |
4TB | 4-(2-THIENYL)BUTYRIC ACID | A,B | 2AY8 | 0.77 |  |
ISF | A,B | 1PGE | 0.85 | | |
M5P | (S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID | A,B | 2YZ3 | 0.7 | |
FLP | FLURBIPROFEN | A,B,C,D | 3PGH | 0.72 | |
| FLP | FLURBIPROFEN | A,B | 1CQE | 0.72 | |
| FLP | FLURBIPROFEN | A,B | 1EQH | 0.72 | |
| FLP | FLURBIPROFEN | A,B | 2AYL | 0.72 | |
| FLP | FLURBIPROFEN | A | 1DVT | 0.72 | |
| FLP | FLURBIPROFEN | A | 1R9O | 0.72 | |
SPA | THIOPHENEACETIC ACID | B | 1AJQ | 0.74 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.7 | |
RP4 | (1S,4S,5S)-1,4,5-TRIHYDROXY-3-[3- (PHENYLTHIO)PHENYL]CYCLOHEX-2-ENE- 1-CARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2CJF | 0.71 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.71 | |
| NLA | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.71 | |
IBP | IBUPROFEN | A | 3FKX | 0.7 | |
| IBP | IBUPROFEN | A,B | 2BXG | 0.7 | |
| IBP | IBUPROFEN | A,B | 1EQG | 0.7 | |
| IBP | IBUPROFEN | A,B,C | 2WD9 | 0.7 | |
| IBP | IBUPROFEN | A | 2PWS | 0.7 | |
4MA | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.71 | |
C21 | THIOPHENE-2-CARBOXYLIC ACID | A,B | 2HDQ | 0.74 | |
C9P | 4-(dihydroxyboranyl)-2-({[4-(phenylsulfonyl)thiophen- 2-yl]sulfonyl}amino)benzoic acid | A,B | 3BM6 | 0.7 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.71 | |
| CIN | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.71 | |
EMT | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B | 1KDG | 0.75 | |
| EMT | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B,C,D | 1O9L | 0.75 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.73 | |
26C | A,B | 2F7I | 0.74 | | |
CPM | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 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 | |
BFL | A,B | 1Q4G | 0.73 | | |
SM2 | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1PI5 | 0.72 | |
| SM2 | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A | 1NXY | 0.72 | |
| SM2 | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1MXO | 0.72 | |
| SM2 | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1YM1 | 0.72 | |
BTP | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.71 | |
ZTW | RALOXIFENE CORE | A,B | 1GWQ | 0.71 | |
FBC | A,B | 2B9A | 0.74 | | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.74 | |
| NDD | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.74 | |
4FC | A | 1YSG | 0.75 | |