BDBM50005400 1,3-Dipropyl-8-(1-propyl-butyl)-3,7-dihydro-purine-2,6-dione::CHEMBL356458

SMILES: CCCC(CCC)c1nc2n(CCC)c(=O)n(CCC)c(=O)c2[nH]1

InChI Key: InChIKey=BRBRZOYKFSNBNB-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50005400   

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 A1 receptor (GUINEA PIG)	BDBM50005400 (1,3-Dipropyl-8-(1-propyl-butyl)-3,7-dihydro-purine...) Show SMILES CCCC(CCC)c1nc2n(CCC)c(=O)n(CCC)c(=O)c2[nH]1 Show InChI InChI=1S/C18H30N4O2/c1-5-9-13(10-6-2)15-19-14-16(20-15)21(11-7-3)18(24)22(12-8-4)17(14)23/h13H,5-12H2,1-4H3,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyowa Hakko Kogyo Co., Ltd. Curated by ChEMBL					Assay Description Binding affinity carried out with [3H]-cyclohexyladenosine in guinea pig forebrain membranes against adenosine A1 receptor				J Med Chem 34: 466-9 (1991) BindingDB Entry DOI: 10.7270/Q2154G0Z
					More data for this Ligand-Target Pair
Adenosine A1 receptor (GUINEA PIG)	BDBM50005400 (1,3-Dipropyl-8-(1-propyl-butyl)-3,7-dihydro-purine...) Show SMILES CCCC(CCC)c1nc2n(CCC)c(=O)n(CCC)c(=O)c2[nH]1 Show InChI InChI=1S/C18H30N4O2/c1-5-9-13(10-6-2)15-19-14-16(20-15)21(11-7-3)18(24)22(12-8-4)17(14)23/h13H,5-12H2,1-4H3,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyowa Hakko Kogyo Co., Ltd. Curated by ChEMBL					Assay Description Binding affinity against adenosine A1 receptor using N6-[3H]cyclohexyladenosine as radioligand in guinea pig forebrain membranes				J Med Chem 35: 924-30 (1992) BindingDB Entry DOI: 10.7270/Q2NS0VJZ
					More data for this Ligand-Target Pair
Adenosine A2 receptor (Rattus norvegicus-Rattus norvegicus (rat))	BDBM50005400 (1,3-Dipropyl-8-(1-propyl-butyl)-3,7-dihydro-purine...) Show SMILES CCCC(CCC)c1nc2n(CCC)c(=O)n(CCC)c(=O)c2[nH]1 Show InChI InChI=1S/C18H30N4O2/c1-5-9-13(10-6-2)15-19-14-16(20-15)21(11-7-3)18(24)22(12-8-4)17(14)23/h13H,5-12H2,1-4H3,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	590	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyowa Hakko Kogyo Co., Ltd. Curated by ChEMBL					Assay Description Binding affinity against adenosine A2 receptor using N-[3H]-ethyladenosin-5''-uronamide as radioligand in rat striatal membranes.				J Med Chem 35: 924-30 (1992) BindingDB Entry DOI: 10.7270/Q2NS0VJZ
					More data for this Ligand-Target Pair
Adenosine A2 receptor (Rattus norvegicus-Rattus norvegicus (rat))	BDBM50005400 (1,3-Dipropyl-8-(1-propyl-butyl)-3,7-dihydro-purine...) Show SMILES CCCC(CCC)c1nc2n(CCC)c(=O)n(CCC)c(=O)c2[nH]1 Show InChI InChI=1S/C18H30N4O2/c1-5-9-13(10-6-2)15-19-14-16(20-15)21(11-7-3)18(24)22(12-8-4)17(14)23/h13H,5-12H2,1-4H3,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	590	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyowa Hakko Kogyo Co., Ltd. Curated by ChEMBL					Assay Description Binding affinity carried out with [3H]5'-(N-ethylcarbamoyl)-adenosine in the presence of 50 nM cyclopentyladenosine in rat striatal membranes against...				J Med Chem 34: 466-9 (1991) BindingDB Entry DOI: 10.7270/Q2154G0Z
					More data for this Ligand-Target Pair