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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Atrial natriuretic peptide receptor 1' and Ligand = 'BDBM50262474'   
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
Atrial natriuretic peptide receptor 1


(Homo sapiens (Human))		BDBM50262474
PNG
(CHEMBL4082303)
Show SMILES CC(C)Nc1nc(N[C@H]2CC[C@@H](CC2)NC(=O)C2CCCN(C)C2)c2cc(ccc2n1)-c1cccc(Cl)c1 |r,wU:11.14,wD:8.7,(63.87,-4.01,;62.54,-4.78,;62.55,-6.32,;61.2,-4.02,;59.87,-4.79,;59.88,-6.34,;58.54,-7.11,;58.54,-8.65,;59.87,-9.42,;59.87,-10.96,;61.19,-11.73,;62.53,-10.97,;62.54,-9.43,;61.2,-8.65,;63.86,-11.74,;65.2,-10.98,;65.21,-9.44,;66.53,-11.75,;67.86,-10.99,;69.19,-11.77,;69.18,-13.31,;67.84,-14.07,;67.83,-15.61,;66.52,-13.29,;57.21,-6.34,;55.88,-7.11,;54.55,-6.35,;54.55,-4.8,;55.88,-4.03,;57.21,-4.8,;58.54,-4.03,;53.22,-7.12,;53.23,-8.65,;51.9,-9.43,;50.56,-8.66,;50.56,-7.12,;49.22,-6.35,;51.89,-6.35,)|
Show InChI InChI=1S/C30H39ClN6O/c1-19(2)32-30-35-27-14-9-21(20-6-4-8-23(31)16-20)17-26(27)28(36-30)33-24-10-12-25(13-11-24)34-29(38)22-7-5-15-37(3)18-22/h4,6,8-9,14,16-17,19,22,24-25H,5,7,10-13,15,18H2,1-3H3,(H,34,38)(H2,32,33,35,36)/t22?,24-,25-
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KEGG

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PC cid
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Similars
Article
PubMed
n/an/an/an/a 260n/an/an/an/a



Asubio Pharma Co. Ltd, 6-4-3, Minatojima-Minamimachi, Chuo-ku, Kobe 650-0047, Japan. Electronic address: iwaki.takehiko.v7@asubio.co.jp.

Curated by ChEMBL


Assay Description
Agonist activity at human NPR-A expressed in CHO cells assessed as increase in intracellular cGMP accumulation after 30 mins in presence of 1-methyl-...

Bioorg Med Chem Lett 27: 4904-4907 (2017)


Article DOI: 10.1016/j.bmcl.2017.09.028
BindingDB Entry DOI: 10.7270/Q279475J
More data for this
Ligand-Target Pair