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BDBM50022788 (2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamido)-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid::(2S,5R,6R)-6-{[3-(2-Chloro-phenyl)-5-methyl-isoxazole-4-carbonyl]-amino}-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid::6-{[3-(2-Chloro-phenyl)-5-methyl-isoxazole-4-carbonyl]-amino}-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid::CHEMBL891::CLOXAPEN::TEGOPEN::cloxacillin
SMILES: Cc1onc(c1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(O)=O)-c1ccccc1Cl
InChI Key: InChIKey=LQOLIRLGBULYKD-UHFFFAOYSA-N
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Bile salt export pump (Human) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | n/a | n/a | 4.16E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
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| Beta-lactamase (Escherichia coli) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| SugE (Salmonella newport) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Beta-lactamase (Pseudomonas aeruginosa (g-Proteobacteria)) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Bile salt export pump (Human) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | n/a | n/a | 2.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Bile salt export pump (Rat) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | n/a | n/a | 3.77E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Solute carrier family 22 member 8 (Mouse) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | n/a | n/a | 3.09E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Beta-lactamase TEM (Escherichia coli) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Solute carrier family 15 member 2 (Human) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | 9.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Solute carrier family 15 member 2 (Rat) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | 9.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Solute carrier family 15 member 1 (Human) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | 2.50E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Solute carrier family 15 member 1 (Human) | BDBM50022788![]() ((2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole...) | GoogleScholar | UniChem | 3.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||