BDBM50224349 4-amino-2-p-tolyl-3,3a,5,9b-tetraaza-cyclopenta[a]naphthalen-1-one::CHEMBL394063

SMILES: Cc1ccc(cc1)-c1nn2c(N)nc3ccccc3n2c1=O

InChI Key: InChIKey=MBVAHTVJNPQBIQ-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50224349   

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 A3 (Homo sapiens (Human))	BDBM50224349 (4-amino-2-p-tolyl-3,3a,5,9b-tetraaza-cyclopenta[a]...) Show SMILES Cc1ccc(cc1)-c1nn2c(N)nc3ccccc3n2c1=O Show InChI InChI=1S/C16H13N5O/c1-10-6-8-11(9-7-10)14-15(22)20-13-5-3-2-4-12(13)18-16(17)21(20)19-14/h2-9H,1H3,(H2,17,18)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	29.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]AB-MECA from human adenosine A3 receptor expressed in CHO cells				J Med Chem 50: 5676-84 (2007) Article DOI: 10.1021/jm0708376 BindingDB Entry DOI: 10.7270/Q2SJ1MFX
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50224349 (4-amino-2-p-tolyl-3,3a,5,9b-tetraaza-cyclopenta[a]...) Show SMILES Cc1ccc(cc1)-c1nn2c(N)nc3ccccc3n2c1=O Show InChI InChI=1S/C16H13N5O/c1-10-6-8-11(9-7-10)14-15(22)20-13-5-3-2-4-12(13)18-16(17)21(20)19-14/h2-9H,1H3,(H2,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells				J Med Chem 50: 5676-84 (2007) Article DOI: 10.1021/jm0708376 BindingDB Entry DOI: 10.7270/Q2SJ1MFX
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50224349 (4-amino-2-p-tolyl-3,3a,5,9b-tetraaza-cyclopenta[a]...) Show SMILES Cc1ccc(cc1)-c1nn2c(N)nc3ccccc3n2c1=O Show InChI InChI=1S/C16H13N5O/c1-10-6-8-11(9-7-10)14-15(22)20-13-5-3-2-4-12(13)18-16(17)21(20)19-14/h2-9H,1H3,(H2,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells				J Med Chem 50: 5676-84 (2007) Article DOI: 10.1021/jm0708376 BindingDB Entry DOI: 10.7270/Q2SJ1MFX
					More data for this Ligand-Target Pair