null

SMILES: CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN(C)C)cc1

InChI Key: InChIKey=VWYYYCIWTDPFEN-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50187662   

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))	BDBM50187662 (CHEMBL3827267) Show SMILES CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN(C)C)cc1 Show InChI InChI=1S/C24H34N6O3/c1-5-12-29-21-20(22(31)30(13-6-2)24(29)32)28-15-7-14-27(23(28)25-21)18-8-10-19(11-9-18)33-17-16-26(3)4/h8-11H,5-7,12-17H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from adenosine receptor A1 in rat brain cortical membranes				Bioorg Med Chem 24: 4347-4362 (2016) BindingDB Entry DOI: 10.7270/Q2R49SQ5
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Homo sapiens (Human))	BDBM50187662 (CHEMBL3827267) Show SMILES CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN(C)C)cc1 Show InChI InChI=1S/C24H34N6O3/c1-5-12-29-21-20(22(31)30(13-6-2)24(29)32)28-15-7-14-27(23(28)25-21)18-8-10-19(11-9-18)33-17-16-26(3)4/h8-11H,5-7,12-17H2,1-4H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]PSB-603 from recombinant human adenosine receptor A2b expressed in CHO cell membranes				Bioorg Med Chem 24: 4347-4362 (2016) BindingDB Entry DOI: 10.7270/Q2R49SQ5
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50187662 (CHEMBL3827267) Show SMILES CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN(C)C)cc1 Show InChI InChI=1S/C24H34N6O3/c1-5-12-29-21-20(22(31)30(13-6-2)24(29)32)28-15-7-14-27(23(28)25-21)18-8-10-19(11-9-18)33-17-16-26(3)4/h8-11H,5-7,12-17H2,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]PSB-603 from recombinant human adenosine receptor A3 expressed in CHO cell membranes				Bioorg Med Chem 24: 4347-4362 (2016) BindingDB Entry DOI: 10.7270/Q2R49SQ5
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Rattus norvegicus (rat))	BDBM50187662 (CHEMBL3827267) Show SMILES CCCn1c2nc3N(CCCn3c2c(=O)n(CCC)c1=O)c1ccc(OCCN(C)C)cc1 Show InChI InChI=1S/C24H34N6O3/c1-5-12-29-21-20(22(31)30(13-6-2)24(29)32)28-15-7-14-27(23(28)25-21)18-8-10-19(11-9-18)33-17-16-26(3)4/h8-11H,5-7,12-17H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]MSX2 from adenosine receptor A2a in rat brain striatal membranes				Bioorg Med Chem 24: 4347-4362 (2016) BindingDB Entry DOI: 10.7270/Q2R49SQ5
					More data for this Ligand-Target Pair