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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'EDNRB' and Ligand = 'BDBM50071424'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
EDNRB


(Homo sapiens (Human))
BDBM50071424
PNG
(CHEMBL263301 | N-[(R)-1-[1-(Butane-1-sulfonylamino...)
Show SMILES CCCCS(=O)(=O)NC(=O)C(NC(=O)[C@@H](Cc1ccc(cc1)-c1ccno1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)O
Show InChI InChI=1S/C30H38N4O7S/c1-6-7-14-42(39,40)33-29(37)27(21(4)35)32-28(36)25(34(5)30(38)24-16-19(2)15-20(3)17-24)18-22-8-10-23(11-9-22)26-12-13-31-41-26/h8-13,15-17,21,25,27,35H,6-7,14,18H2,1-5H3,(H,32,36)(H,33,37)/t21?,25-,27?/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
3.20n/an/an/an/an/an/an/an/a



Takarazuka Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to Endothelin B receptor


Bioorg Med Chem Lett 8: 2241-6 (1999)


BindingDB Entry DOI: 10.7270/Q2BC3XQ7
More data for this
Ligand-Target Pair