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BDBM281046 US10022352, Compound 307

SMILES: CC(C)(C)c1cc2cc(NC(=O)C3(CC3)c3ccc4CCCc4c3)ccc2n1C[C@@H](O)CO

InChI Key: InChIKey=KVZMYJRGSRFFDD-HSZRJFAPSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 281046   
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
Cystic fibrosis transmembrane conductance regulator


(Homo sapiens (Human))		BDBM281046
PNG
(US10022352, Compound 307)
Show SMILES CC(C)(C)c1cc2cc(NC(=O)C3(CC3)c3ccc4CCCc4c3)ccc2n1C[C@@H](O)CO |r|
Show InChI InChI=1S/C28H34N2O3/c1-27(2,3)25-15-20-14-22(9-10-24(20)30(25)16-23(32)17-31)29-26(33)28(11-12-28)21-8-7-18-5-4-6-19(18)13-21/h7-10,13-15,23,31-32H,4-6,11-12,16-17H2,1-3H3,(H,29,33)/t23-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 981n/an/an/an/a



Vertex Pharmaceuticals Incorporated

US Patent


Assay Description
Single-Channel Recordings activity of wt-CFTR and temperature-corrected ΔF508-CFTR expressed in NIH3T3 cells was observed using excised inside-o...

US Patent US10022352 (2018)


BindingDB Entry DOI: 10.7270/Q2T43W44
More data for this
Ligand-Target Pair