null
SMILES: COc1ccc(cc1)-c1nn(cc1\C=N/NC1=NC(=O)CS1)-c1ccccc1
InChI Key: InChIKey=JUCBMIDXALUABN-NHDPSOOVSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50035992 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 |
Prostaglandin G/H synthase 2
(Ovis aries (Sheep)) | BDBM50035992
(CHEMBL3338725)Show SMILES COc1ccc(cc1)-c1nn(cc1\C=N/NC1=NC(=O)CS1)-c1ccccc1 |t:18| Show InChI InChI=1S/C20H17N5O2S/c1-27-17-9-7-14(8-10-17)19-15(11-21-23-20-22-18(26)13-28-20)12-25(24-19)16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H,22,23,26)/b21-11- | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
KLE University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX2 |
Bioorg Med Chem Lett 24: 5324-9 (2015)
Article DOI: 10.1016/j.bmcl.2014.08.062 BindingDB Entry DOI: 10.7270/Q2X92CXH |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM50035992
(CHEMBL3338725)Show SMILES COc1ccc(cc1)-c1nn(cc1\C=N/NC1=NC(=O)CS1)-c1ccccc1 |t:18| Show InChI InChI=1S/C20H17N5O2S/c1-27-17-9-7-14(8-10-17)19-15(11-21-23-20-22-18(26)13-28-20)12-25(24-19)16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H,22,23,26)/b21-11- | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 7.13E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
KLE University
Curated by ChEMBL
| Assay Description Inhibition of ovine COX1 |
Bioorg Med Chem Lett 24: 5324-9 (2015)
Article DOI: 10.1016/j.bmcl.2014.08.062 BindingDB Entry DOI: 10.7270/Q2X92CXH |
More data for this Ligand-Target Pair | |