BDBM50382176 CHEMBL1902481::cid_867556
SMILES: CC(=O)c1sc(Nc2ccc(Oc3ccccc3)cc2)nc1C
InChI Key: InChIKey=KVOBDWOIPFHWSD-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 3 hits for monomerid = 50382176 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 |
nuclear receptor subfamily 0 group B member 1
(Homo sapiens (Human)) | BDBM50382176
(CHEMBL1902481 | cid_867556)Show InChI InChI=1S/C18H16N2O2S/c1-12-17(13(2)21)23-18(19-12)20-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,1-2H3,(H,19,20) | KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| PCBioAssay
| n/a | n/a | >6.76E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center
Curated by PubChem BioAssay
| |
PubChem Bioassay (2013)
BindingDB Entry DOI: 10.7270/Q23777B0 |
More data for this Ligand-Target Pair | |
Cyclooxygenase
(Homo sapiens (Human)) | BDBM50382176
(CHEMBL1902481 | cid_867556)Show InChI InChI=1S/C18H16N2O2S/c1-12-17(13(2)21)23-18(19-12)20-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,1-2H3,(H,19,20) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Arizona
Curated by ChEMBL
| Assay Description Inhibition of COX2 by fluorescence assay |
Bioorg Med Chem Lett 22: 3567-70 (2012)
Article DOI: 10.1016/j.bmcl.2012.03.013 BindingDB Entry DOI: 10.7270/Q2RB75MP |
More data for this Ligand-Target Pair | |
Steroidogenic Factor 1
(Homo sapiens (Human)) | BDBM50382176
(CHEMBL1902481 | cid_867556)Show InChI InChI=1S/C18H16N2O2S/c1-12-17(13(2)21)23-18(19-12)20-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,1-2H3,(H,19,20) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| PCBioAssay
| n/a | n/a | >6.76E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center
Curated by PubChem BioAssay
| |
PubChem Bioassay (2013)
BindingDB Entry DOI: 10.7270/Q2ZG6QV9 |
More data for this Ligand-Target Pair | |