Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Apelin receptor' and Ligand = 'BDBM50577755'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Apelin receptor (Rattus norvegicus)	BDBM50577755 (CHEMBL4861895) Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(C)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(56.32,-36.8,;57.65,-37.57,;58.99,-36.8,;60.32,-37.56,;61.65,-36.79,;61.65,-35.25,;62.99,-34.48,;62.99,-32.94,;64.32,-35.25,;65.66,-34.48,;67.06,-35.1,;68.09,-33.96,;67.32,-32.63,;67.95,-31.22,;69.48,-31.06,;70.1,-29.66,;71.62,-29.49,;72.54,-30.74,;74.07,-30.58,;71.91,-32.15,;70.38,-32.31,;65.81,-32.95,;64.32,-36.78,;65.66,-37.55,;62.99,-37.55,;63,-39.08,;64.33,-39.85,;65.66,-39.07,;67,-39.84,;64.34,-41.4,;63,-42.17,;61.66,-41.4,;61.67,-39.85,;60.33,-39.08,;59,-39.85,)| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.0240	n/a	n/a	n/a	n/a
TBA					Assay Description Agonist activity at rat APJ receptor expressed in HEK293T cells assessed as compound stimulated inhibition of forskolin stimulated cAMP production in...				Citation and Details Article DOI: 10.1021/acsmedchemlett.1c00385 BindingDB Entry DOI: 10.7270/Q2M330MF
					More data for this Ligand-Target Pair
Apelin receptor (Homo sapiens (Human))	BDBM50577755 (CHEMBL4861895) Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(C)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(56.32,-36.8,;57.65,-37.57,;58.99,-36.8,;60.32,-37.56,;61.65,-36.79,;61.65,-35.25,;62.99,-34.48,;62.99,-32.94,;64.32,-35.25,;65.66,-34.48,;67.06,-35.1,;68.09,-33.96,;67.32,-32.63,;67.95,-31.22,;69.48,-31.06,;70.1,-29.66,;71.62,-29.49,;72.54,-30.74,;74.07,-30.58,;71.91,-32.15,;70.38,-32.31,;65.81,-32.95,;64.32,-36.78,;65.66,-37.55,;62.99,-37.55,;63,-39.08,;64.33,-39.85,;65.66,-39.07,;67,-39.84,;64.34,-41.4,;63,-42.17,;61.66,-41.4,;61.67,-39.85,;60.33,-39.08,;59,-39.85,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.0230	n/a	n/a	n/a	n/a
TBA					Assay Description Agonist activity at human APJ receptor expressed in HEK293T cells assessed as compound stimulated inhibition of forskolin stimulated cAMP production ...				Citation and Details Article DOI: 10.1021/acsmedchemlett.1c00385 BindingDB Entry DOI: 10.7270/Q2M330MF
					More data for this Ligand-Target Pair