BDBM50181323 2,5-DICHLORO-N-(5-CHLORO-1,3-BENZOXAZOL-2-YL)BENZENESULFONAMIDE::2,5-dichloro-N-(5-chlorobenzo[d]oxazol-2-yl)benzenesulfonamide::CHEMBL207095
SMILES: Clc1ccc(Cl)c(c1)S(=O)(=O)Nc1nc2cc(Cl)ccc2o1
InChI Key: InChIKey=JCXZHFCBNFFHRC-UHFFFAOYSA-N
Data: 1 IC50
PDB links: 1 PDB ID matches this monomer.
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50181323 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Fructose-1,6-bisphosphatase
(Homo sapiens (Human)) | BDBM50181323
(2,5-DICHLORO-N-(5-CHLORO-1,3-BENZOXAZOL-2-YL)BENZE...)Show SMILES Clc1ccc(Cl)c(c1)S(=O)(=O)Nc1nc2cc(Cl)ccc2o1 Show InChI InChI=1S/C13H7Cl3N2O3S/c14-7-2-4-11-10(5-7)17-13(21-11)18-22(19,20)12-6-8(15)1-3-9(12)16/h1-6H,(H,17,18) | PDB
UniProtKB/SwissProt
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CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Similars
| PDB
| n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this Ligand-Target Pair | 3D Structure (crystal) |
Fructose-1,6-bisphosphatase 1 (FBPase)
(Homo sapiens (Human)) | BDBM50181323
(2,5-DICHLORO-N-(5-CHLORO-1,3-BENZOXAZOL-2-YL)BENZE...)Show SMILES Clc1ccc(Cl)c(c1)S(=O)(=O)Nc1nc2cc(Cl)ccc2o1 Show InChI InChI=1S/C13H7Cl3N2O3S/c14-7-2-4-11-10(5-7)17-13(21-11)18-22(19,20)12-6-8(15)1-3-9(12)16/h1-6H,(H,17,18) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description Inhibition of human FBPase1 |
Bioorg Med Chem Lett 16: 1807-10 (2006)
Article DOI: 10.1016/j.bmcl.2006.01.014 BindingDB Entry DOI: 10.7270/Q2J965ZK |
More data for this Ligand-Target Pair | 3D Structure (crystal) |