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SMILES: O=c1n(Cc2ccccc2)cnc2cc(ccc12)-c1cn[nH]c1

InChI Key:

PDB links: 1 PDB ID matches this monomer.

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 4 hits for monomerid = 50554259   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Beta-adrenergic receptor kinase 1 (Homo sapiens (Human))	BDBM50554259 (CHEMBL4788026) Show SMILES O=c1n(Cc2ccccc2)cnc2cc(ccc12)-c1cn[nH]c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	n/a	3.33E+3	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to full length human GRK2 by Thermofluor thermal shift assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127602 BindingDB Entry DOI: 10.7270/Q2H135PS
					More data for this Ligand-Target Pair				3D Structure (crystal)
G protein-coupled receptor kinase 5 (Homo sapiens (Human))	BDBM50554259 (CHEMBL4788026) Show SMILES O=c1n(Cc2ccccc2)cnc2cc(ccc12)-c1cn[nH]c1 Show InChI	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	n/a	>8.33E+4	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to GRK5 (unknown origin) by Thermofluor thermal shift assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127602 BindingDB Entry DOI: 10.7270/Q2H135PS
					More data for this Ligand-Target Pair
Rhodopsin kinase GRK1 (Homo sapiens (Human))	BDBM50554259 (CHEMBL4788026) Show SMILES O=c1n(Cc2ccccc2)cnc2cc(ccc12)-c1cn[nH]c1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	n/a	4.76E+4	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to GRK1 (unknown origin) by Thermofluor thermal shift assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127602 BindingDB Entry DOI: 10.7270/Q2H135PS
					More data for this Ligand-Target Pair
Beta-adrenergic receptor kinase 1 (Homo sapiens (Human))	BDBM50554259 (CHEMBL4788026) Show SMILES O=c1n(Cc2ccccc2)cnc2cc(ccc12)-c1cn[nH]c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GRK2 by transcreener assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127602 BindingDB Entry DOI: 10.7270/Q2H135PS
					More data for this Ligand-Target Pair				3D Structure (crystal)