Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03223649
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 |
BYM![]() | (5E)-5-[(2,2-DIFLUORO-1,3-BENZODIOXOL- 5-YL)METHYLENE]-1,3-THIAZOLIDINE- 2,4-DIONE | A | 2A4Z | 0.77 | ![]() |
R22![]() | 4-(3,5-DIMETHYLPHENOXY)-5-(FURAN- 2-YLMETHYLSULFANYLMETHYL)-3-IODO- 6-METHYLPYRIDIN-2(1H)-ONE | A,B | 2BE2 | 0.77 | ![]() |
K55![]() | (2S)-2-{4-butoxy-3-[({[2-fluoro- 4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]benzyl}butanoic acid | A,B | 2ZNP | 0.72 | ![]() |
AZ2![]() | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A,B | 1I7I | 0.7 | ![]() |
AZ2![]() | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A | 1I7G | 0.7 | ![]() |
MFM![]() | (E)-3-(5((5-(4-CHLOROPHENYL)FURAN- 2-YL)METHYLENE)-4-OXO-2-THIOXOTHIAZOLIDIN- 3-YL)PROPANOIC ACID | A,B | 1ZXV | 0.71 | ![]() |
RNA![]() | 4-METHYL-N-{(5E)-5-[(5-METHYL-2- FURYL)METHYLENE]-4-OXO-4,5-DIHYDRO- 1,3-THIAZOL-2-YL}BENZENESULFONAMIDE | A,B | 2HWH | 0.7 | ![]() |
CIO![]() | CILOMILAST | A,B | 1XOM | 0.73 | ![]() |
CIO![]() | CILOMILAST | A,B | 1XLX | 0.73 | ![]() |
BBB![]() | 1-((2-HYDROXYETHOXY)METHYL)-5-(3- (BENZYLOXY)BENZYL)-6-HYDROXYPYRIMIDINE- 2,4(1H,3H)-DIONE | A,B,C,D,E,F | 1U1G | 0.71 | ![]() |
C94![]() | 4-{5-[(Z)-(2-IMINO-4-OXO-1,3-THIAZOLIDIN- 5-YLIDENE)METHYL]FURAN-2-YL}-2- (TRIFLUOROMETHYL)BENZENESULFONAMIDE | A,C | 2UZL | 0.7 | ![]() |
MPP![]() | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.72 | ![]() |
C95![]() | 4-{5-[(Z)-(2-IMINO-4-OXO-1,3-THIAZOLIDIN- 5-YLIDENE)METHYL]FURAN-2-YL}BENZOIC ACID | A,C | 2UZE | 0.77 | ![]() |
TDZ![]() | (5R)-5-(4-{[(2R)-6-HYDROXY-2,5,7,8- TETRAMETHYL-3,4-DIHYDRO-2H-CHROMEN- 2-YL]METHOXY}BENZYL)-1,3-THIAZOLIDINE- 2,4-DIONE | A,B | 2QM9 | 0.75 | ![]() |
TDZ![]() | (5R)-5-(4-{[(2R)-6-HYDROXY-2,5,7,8- TETRAMETHYL-3,4-DIHYDRO-2H-CHROMEN- 2-YL]METHOXY}BENZYL)-1,3-THIAZOLIDINE- 2,4-DIONE | A | 2VN0 | 0.75 | ![]() |
183![]() | 1-((2-HYDROXYETHOXY)METHYL)-5-(3- (BENZYLOXY)BENZYL)PYRIMIDINE-2,4(1H,3H)- DIONE | A,B,C,D,E,F | 1U1F | 0.7 | ![]() |
HWG![]() | N-(TERT-BUTYL)-3,5-DIMETHYL-N'- [(5-METHYL-2,3-DIHYDRO-1,4-BENZODIOXIN- 6-YL)CARBONYL]BENZOHYDRAZIDE | A,D | 1R20 | 0.72 | ![]() |
4SR![]() | (4S)-4-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]PYRROLIDIN- 2-ONE | A,B | 1XN0 | 0.73 | ![]() |
C85![]() | 4-{5-[(Z)-(2-IMINO-4-OXO-1,3-THIAZOLIDIN- 5-YLIDENE)METHYL]FURAN-2-YL}BENZENESULFONAMIDE | A,C | 2UZD | 0.73 | ![]() |
SB8![]() | 2-(3-BENZOYLPHENOXY)ETHYL(HYDROXY)FORMAMIDE | A | 2AIA | 0.73 | ![]() |
NBF![]() | [(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACID | A | 1NY0 | 0.7 | ![]() |
NBF![]() | [(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACID | A,B | 1YMS | 0.7 | ![]() |
8MO![]() | METHOXSALEN | A,B,C,D | 1Z11 | 0.7 | ![]() |
VXX![]() | VANILLATE | A,B | 1WB6 | 0.71 | ![]() |
Y12![]() | 4-{(1E)-3-OXO-3-[(2-PHENYLETHYL)AMINO]PROP- 1-EN-1-YL}-1,2-PHENYLENE DIACETATE | A | 2EW5 | 0.78 | ![]() |
ROL![]() | ROLIPRAM | A,B,C,D | 1OYN | 0.73 | ![]() |
ROL![]() | ROLIPRAM | A,B | 1XMY | 0.73 | ![]() |
ROL![]() | ROLIPRAM | A,B,C,D | 1Q9M | 0.73 | ![]() |
ROL![]() | ROLIPRAM | A,B | 1RO6 | 0.73 | ![]() |
ROL![]() | ROLIPRAM | A,B | 1XN0 | 0.73 | ![]() |
ROL![]() | ROLIPRAM | A,B | 1TBB | 0.73 | ![]() |
C62![]() | 4-{5-[(Z)-(2,4-DIOXO-1,3-THIAZOLIDIN- 5-YLIDENE)METHYL]FURAN-2-YL}BENZENESULFONAMIDE | A | 2UZO | 0.77 | ![]() |
AI7![]() | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.73 | ![]() |
D27![]() | 2-{[(2E)-3-(3,4-dimethoxyphenyl)prop- 2-enoyl]amino}benzoic acid | A,B,C,D | 2VD0 | 0.73 | ![]() |
C96![]() | 4-{5-[(1Z)-1-(2-IMINO-4-OXO-1,3- THIAZOLIDIN-5-YLIDENE)ETHYL]-2- FURYL}BENZENESULFONAMIDE | A | 2UZN | 0.73 | ![]() |
DEO![]() | A,B | 1ROS | 0.71 | ![]() | |
VNL![]() | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.71 | ![]() |
VNL![]() | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.71 | ![]() |
GRR![]() | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.7 | ![]() |
C75![]() | 4-{5-[(Z)-(2-IMINO-4-OXO-1,3-THIAZOLIDIN- 5-YLIDENE)METHYL]-2-FURYL}-N-METHYLBENZENESULFONAMIDE | A,C | 2UZB | 0.72 | ![]() |
3MB![]() | 3-METHOXYBENZAMIDE | A | 3PAX | 0.73 | ![]() |
MAX![]() | MATAIRESINOL | A | 2BGM | 0.73 | ![]() |
TMS![]() | N-PROPYL-4-[(E)-2-(3,4,5-TRIMETHOXY- PHENYL)-VINYL]-BENZAMIDE | A,B | 1X6W | 0.72 | ![]() |