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SMILES: Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(Cn3c(C)nc4ccccc34)cc2)c1C

InChI Key: InChIKey=MCGCJFJGNKEDPW-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50387807   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50387807
PNG
(CHEMBL2058367)
Show SMILES Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(Cn3c(C)nc4ccccc34)cc2)c1C
Show InChI InChI=1S/C26H24N4O3S/c1-17-18(2)28-33-26(17)29-34(31,32)25-11-7-4-8-22(25)21-14-12-20(13-15-21)16-30-19(3)27-23-9-5-6-10-24(23)30/h4-15,29H,16H2,1-3H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 75n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Antagonist activity at human endothelin receptor subtype A expressed in CHO-K1 cells


Bioorg Med Chem 20: 4661-7 (2012)


Article DOI: 10.1016/j.bmc.2012.06.011
BindingDB Entry DOI: 10.7270/Q2G73FS6
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(Bos taurus)
BDBM50387807
PNG
(CHEMBL2058367)
Show SMILES Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(Cn3c(C)nc4ccccc34)cc2)c1C
Show InChI InChI=1S/C26H24N4O3S/c1-17-18(2)28-33-26(17)29-34(31,32)25-11-7-4-8-22(25)21-14-12-20(13-15-21)16-30-19(3)27-23-9-5-6-10-24(23)30/h4-15,29H,16H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 45n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Displacement of [125I]AngII from type 1 angiotensin 2 receptor in bovine adrenal cortex


Bioorg Med Chem 20: 4661-7 (2012)


Article DOI: 10.1016/j.bmc.2012.06.011
BindingDB Entry DOI: 10.7270/Q2G73FS6
More data for this
Ligand-Target Pair