Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01026281
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 |
CCT | 5-(4-CYANOPHENYL)-3-{[(2-METHYLPHENYL)SULFONYL]AMINO}THIOPHENE- 2-CARBOXYLIC ACID | A,B | 2D3U | 0.72 | |
53N | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.7 | |
KST | N~6~-(5-CARBOXY-3-THIENYL)-L-LYSINE | A | 2QA3 | 0.79 | |
KST | N~6~-(5-CARBOXY-3-THIENYL)-L-LYSINE | A | 2Q7W | 0.79 | |
KST | N~6~-(5-CARBOXY-3-THIENYL)-L-LYSINE | A | 2QBT | 0.79 | |
KST | N~6~-(5-CARBOXY-3-THIENYL)-L-LYSINE | A | 2QB3 | 0.79 | |
KST | N~6~-(5-CARBOXY-3-THIENYL)-L-LYSINE | A | 2QB2 | 0.79 | |
C9P | 4-(dihydroxyboranyl)-2-({[4-(phenylsulfonyl)thiophen- 2-yl]sulfonyl}amino)benzoic acid | A,B | 3BM6 | 0.75 | |
MRE | 2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID | A,B | 2V9C | 0.72 | |
ME1 | 5-CHLORO-N-(2-(4-(2-OXOPYRIDIN- 1(2H)-YL)BENZAMIDO)ETHYL)THIOPHENE- 2-CARBOXAMIDE | A | 2P93 | 0.74 | |
DN1 | 3-({(2S)-2-[({(1R)-1-[({(1R)-1- [(R)-CARBOXY(HYDROXY)METHYL]-3,3- DIFLUOROPROPYL}AMINO)CARBONYL]- 3-METHYLBUTYL}AMINO)CARBONYL]-2,3- DIHYDRO-1H-INDOL-2-YL}METHYL)THIOPHENE- 2-CARBOXYLIC ACID | A,B | 1W3C | 0.71 | |
ILC | A | 2FPV | 0.72 | ||
DN2 | 3-({(2S)-2-[({(1S)-1-[({(1S)-1- [(R)-CARBOXY(HYDROXY)METHYL]-3,3- DIFLUOROPROPYL}AMINO)CARBONYL]- 3-METHYLBUTYL}AMINO)CARBONYL]-2,3- DIHYDRO-1H-INDOL-2-YL}METHYL)THIOPHENE- 2-CARBOXYLIC ACID | A,B | 1W3C | 0.71 | |
A41 | 5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID | A | 1YW7 | 0.7 | |
K01 | N,N-DIETHYL-2-[(2-THIENYLCARBONYL)AMINO]- 4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE- 3-CARBOXAMIDE | A,B | 2PG2 | 0.7 | |
GV9 | 3-(acetylamino)thiophene-2-carboxylic acid | A,B | 3GV9 | 0.7 | |
FIH | 5-(4-FLUOROPHENYL)-3-{[(4-METHYLPHENYL)SULFONYL]AMINO}THIOPHENE- 2-CARBOXYLIC ACID | A,B | 2D3Z | 0.73 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A,B | 1BM7 | 0.73 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 1S2C | 0.73 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 2PIX | 0.73 | |
DY6 | 2-({[3-(3,4-dihydroisoquinolin- 2(1H)-ylsulfonyl)phenyl]carbonyl}amino)benzoic acid | A,B | 3DY6 | 0.71 | |
JPC | 3-[(2,4-DICHLOROBENZOYL)(ISOPROPYL)AMINO]- 5-PHENYLTHIOPHENE-2-CARBOXYLIC ACID | A | 1YVZ | 0.75 | |
901 | 2-[(4-{2-ACETYLAMINO-2-[4-(1-CARBOXY- 3-METHYLSULFANYL-PROPYLCARBAMOYL)- BUTYLCARBAMOYL]-ETHYL}-2-ETHYL- PHENYL)-OXALYL-AMINO]-BENZOIC ACID | A | 1NZ7 | 0.7 | |
ME5 | 5-CHLORO-N-((1R,2S)-2-(4-(2-OXOPYRIDIN- 1(2H)-YL)BENZAMIDO) CYCLOPENTYL)THIOPHENE- 2-CARBOXAMIDE | A | 2P95 | 0.72 | |
IPC | 3-[ISOPROPYL(4-METHYLBENZOYL)AMINO]- 5-PHENYLTHIOPHENE-2-CARBOXYLIC ACID | A | 1YVX | 0.81 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.77 |