Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01975946
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 |
RIV | 5-chloro-N-({(5S)-2-oxo-3-[4-(3- oxomorpholin-4-yl)phenyl]-1,3-oxazolidin- 5-yl}methyl)thiophene-2-carboxamide | A | 2W26 | 0.7 | |
K03 | N,N-DIETHYL-5,5-DIMETHYL-2-[(2- THIENYLCARBONYL)AMINO]-4,5,6,7- TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE | A,B | 2UYM | 0.7 | |
D16 | TOMUDEX | A,B | 1I00 | 0.73 | |
D16 | TOMUDEX | A,B | 2KCE | 0.73 | |
D16 | TOMUDEX | A,B,C,D | 2TSR | 0.73 | |
D16 | TOMUDEX | A,B,C,D | 1HVY | 0.73 | |
D16 | TOMUDEX | A,B | 1RTS | 0.73 | |
4CP | 2-[2-(4-CHLORO-PHENYLSULFANYL)- ACETYLAMINO]-3-(4-GUANIDINO-PHENYL)- PROPIONAMIDE | H,I | 2BVR | 0.74 | |
K01 | N,N-DIETHYL-2-[(2-THIENYLCARBONYL)AMINO]- 4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE- 3-CARBOXAMIDE | A,B | 2PG2 | 0.71 | |
AXB | A | 3DPE | 0.7 | ||
AXB | A,B | 3DPF | 0.7 | ||
XLC | 3-CHLORO-N-[4-CHLORO-2-[[(4-CHLOROPHENYL)AMINO]CARBONYL]PHENYL]- 4-[(4-METHYL-1-PIPERAZINYL)METHYL]- 2-THIOPHENECARBOXAMIDE | A,L | 1MQ5 | 0.79 | |
ME5 | 5-CHLORO-N-((1R,2S)-2-(4-(2-OXOPYRIDIN- 1(2H)-YL)BENZAMIDO) CYCLOPENTYL)THIOPHENE- 2-CARBOXAMIDE | A | 2P95 | 0.81 | |
LZH | 5-CHLORO-THIOPHENE-2-CARBOXYLIC ACID ((3R,5S)- 1-{[2-FLUORO-4-(2-OXO-PYRIDIN-1- YL)-PHENYLCARBAMOYL]-METHYL}-5- HYDROXYMETHYL-PYRROLIDIN-3-YL)- AMIDE | A | 2VWL | 0.73 | |
LZF | 5-chloro-N-[(3S,4S)-1-(2-{[2-fluoro- 4-(2-oxopyridin-1(2H)-yl)phenyl]amino}- 2-oxoethyl)-4-methoxypyrrolidin- 3-yl]thiophene-2-carboxamide | A,B | 2VVC | 0.75 | |
H22 | 5-chloro-N-[(3R)-1-(2-{[2-fluoro- 4-(2-oxopyridin-1(2H)-yl)phenyl]amino}- 2-oxoethyl)pyrrolidin-3-yl]thiophene- 2-carboxamide | A | 2VVU | 0.79 | |
38M | 3-(3-chlorophenyl)-2-({(1S)-1-[(6S)- 2,8-diazaspiro[5.5]undec-2-ylcarbonyl]pentyl}sulfanyl)quinazolin- 4(3H)-one | A | 3F9N | 0.75 | |
K02 | (5R)-N,N-DIETHYL-5-METHYL-2-[(THIOPHEN- 2-YLCARBONYL)AMINO]-4,5,6,7-TETRAHYDRO- 1-BENZOTHIOPHENE-3-CARBOXAMIDE | A,B | 2UYI | 0.71 | |
ME1 | 5-CHLORO-N-(2-(4-(2-OXOPYRIDIN- 1(2H)-YL)BENZAMIDO)ETHYL)THIOPHENE- 2-CARBOXAMIDE | A | 2P93 | 0.83 | |
LZI | (4R)-4-{[(5-chlorothiophen-2-yl)carbonyl]amino}- N-(cyclopropylmethyl)-1-(2-{[2- fluoro-4-(2-oxopyridin-1(2H)-yl)phenyl]amino}- 2-oxoethyl)-L-prolinamide | A,B | 2VWM | 0.77 | |
LZG | 5-CHLORO-THIOPHENE-2-CARBOXYLIC ACID ((3S,4S)- 4-FLUORO- 1-{[2-FLUORO-4-(2-OXO- 2H-PYRIDIN-1-YL)-PHENYLCARBAMOYL]- METHYL}-PYRROLIDIN-3-YL)-AMIDE | A | 2VWO | 0.79 | |
H21 | 5-chloro-N-[1-(2-{[2-fluoro-4-(2- oxopyridin-1(2H)-yl)phenyl]amino}- 2-oxoethyl)-1H-1,2,4-triazol-3- yl]thiophene-2-carboxamide | A | 2VVV | 0.75 | |
H25 | 5-Chloro-thiophene-2-carboxylic acid ((3S,4S)- 1-{[2-fluoro-4-(2-oxo-2H-pyridin- 1-yl)-phenylcarbamoyl]-methyl}- 4-hydroxy-pyrrolidin-3-yl)-amide | A | 2VWN | 0.74 |