BDBM50014271 7-Hexyl-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine::CHEMBL95091

SMILES: CCCCCCn1c(C)c(C)c2c(N)ncnc12

InChI Key: InChIKey=RGPDNZHZYSQNNL-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50014271   

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
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50014271 (7-Hexyl-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-...) Show SMILES CCCCCCn1c(C)c(C)c2c(N)ncnc12 Show InChI InChI=1S/C14H22N4/c1-4-5-6-7-8-18-11(3)10(2)12-13(15)16-9-17-14(12)18/h9H,4-8H2,1-3H3,(H2,15,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes Curated by ChEMBL					Assay Description Binding affinity against Adenosine A1 receptor from rat brain membrane using [3H]-R-PIA as radioligand				J Med Chem 33: 2822-8 (1990) BindingDB Entry DOI: 10.7270/Q27D2T4D
					More data for this Ligand-Target Pair
Adenosine A2 receptor (Rattus norvegicus-Rattus norvegicus (rat))	BDBM50014271 (7-Hexyl-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-...) Show SMILES CCCCCCn1c(C)c(C)c2c(N)ncnc12 Show InChI InChI=1S/C14H22N4/c1-4-5-6-7-8-18-11(3)10(2)12-13(15)16-9-17-14(12)18/h9H,4-8H2,1-3H3,(H2,15,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2.63E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes Curated by ChEMBL					Assay Description Binding affinity against Adenosine A2 receptor from rat striatal membrane using [3H]NECA as radioligand				J Med Chem 33: 2822-8 (1990) BindingDB Entry DOI: 10.7270/Q27D2T4D
					More data for this Ligand-Target Pair