Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01259765
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 |
738![]() | N-(3-cyano-4,5,6,7-tetrahydro-1- benzothien-2-yl)-2-fluorobenzamide | A | 2O2U | 0.74 | ![]() |
K01![]() | N,N-DIETHYL-2-[(2-THIENYLCARBONYL)AMINO]- 4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE- 3-CARBOXAMIDE | A,B | 2PG2 | 0.81 | ![]() |
1LG![]() | 2,4-DICHLORO-N-(3-CYANO-4,5,6,7- TETRAHYDRO-BENZOTHIOPHEN-2YL)-5- (MORPHOLINE-4-SULFONYL)-BENZAMIDE | A | 2AM1 | 0.72 | ![]() |
F20![]() | N-BENZOYL-L-PHENYLALANYL-4-[(5S)- 1,1-DIOXIDO-3-OXOISOTHIAZOLIDIN- 5-YL]-L-PHENYLALANINAMIDE | A | 2CMA | 0.72 | ![]() |
2LG![]() | 2-CHLORO-N-(3-CYANO-5,6-DIHYDRO- 4H-CYCLOPENTA[B]THIOPHEN-2-YL)- 5-DIETHYLSULFAMOYL-BENZAMIDE | A | 2AM2 | 0.72 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A,B | 3GEY | 0.72 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A | 3CE0 | 0.72 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A,B | 1XK9 | 0.72 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A | 2Q6M | 0.72 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A,B,C,D,E,F | 1ZM9 | 0.72 | ![]() |
AXX![]() | 2-[(CYCLOPROPYLCARBONYL)AMINO]- 4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE- 3-CARBOXAMIDE | A,B | 2PZI | 0.75 | ![]() |
C0M![]() | N-{3-CYANO-6-[3-(1-PIPERIDINYL)PROPANOYL]- 4,5,6,7-TETRAHYDROTHIENO[2,3-C]PYRIDIN- 2-YL}1-NAPHTHALENECARBOXAMIDE | A | 2O0U | 0.77 | ![]() |
AXB![]() | A | 3DPE | 0.79 | ![]() | |
AXB![]() | A,B | 3DPF | 0.79 | ![]() | |
XLC![]() | 3-CHLORO-N-[4-CHLORO-2-[[(4-CHLOROPHENYL)AMINO]CARBONYL]PHENYL]- 4-[(4-METHYL-1-PIPERAZINYL)METHYL]- 2-THIOPHENECARBOXAMIDE | A,L | 1MQ5 | 0.75 | ![]() |
GSV![]() | 2-(5-chlorothiophen-2-yl)-N-{(3S)- 1-[3-fluoro-2'-(methylsulfonyl)biphenyl- 4-yl]-2-oxopyrrolidin-3-yl}ethanesulfonamide | A | 2VH6 | 0.71 | ![]() |
I52![]() | N-{4-[(1-HYDROXYCARBAMOYL-2-METHYL- PROPYL)-(2-MORPHOLIN-4-YL-ETHYL)- SULFAMOYL]-4-PENTYL-BENZAMIDE | A | 1HOV | 0.71 | ![]() |
K03![]() | N,N-DIETHYL-5,5-DIMETHYL-2-[(2- THIENYLCARBONYL)AMINO]-4,5,6,7- TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE | A,B | 2UYM | 0.8 | ![]() |
K02![]() | (5R)-N,N-DIETHYL-5-METHYL-2-[(THIOPHEN- 2-YLCARBONYL)AMINO]-4,5,6,7-TETRAHYDRO- 1-BENZOTHIOPHENE-3-CARBOXAMIDE | A,B | 2UYI | 0.8 | ![]() |