BDBM50423917 2-(3-Phenyl-1Hpyrazol- 5-yl)aniline (10)::CHEMBL2312728

SMILES: Nc1ccccc1-c1cc(n[nH]1)-c1ccccc1

InChI Key: InChIKey=FVKUPYYECMDEOO-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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 = 50423917   

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))	BDBM50423917 (2-(3-Phenyl-1Hpyrazol- 5-yl)aniline (10) | CHEMBL2...) Show SMILES Nc1ccccc1-c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C15H13N3/c16-13-9-5-4-8-12(13)15-10-14(17-18-15)11-6-2-1-3-7-11/h1-10H,16H2,(H,17,18)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	680	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' di Firenze Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells by scintillation counting				Bioorg Med Chem 21: 283-94 (2012) Article DOI: 10.1016/j.bmc.2012.10.031 BindingDB Entry DOI: 10.7270/Q21837TG
					More data for this Ligand-Target Pair
Xanthine dehydrogenase (Bos taurus (Bovine))	BDBM50423917 (2-(3-Phenyl-1Hpyrazol- 5-yl)aniline (10) | CHEMBL2...) Show SMILES Nc1ccccc1-c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C15H13N3/c16-13-9-5-4-8-12(13)15-10-14(17-18-15)11-6-2-1-3-7-11/h1-10H,16H2,(H,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.17E+4	n/a	n/a	n/a	n/a	7.5	25
Central University of Punjab					Assay Description The reaction mixture contained 1.5 mL of 50 mM potassium phosphate buffer (pH 7.5), 1 mL test sample solutions (5, 10, 25, 50, and 100 µM) was d...				Bioorg Chem 57: 57-64 (2014) Article DOI: 10.1016/j.bioorg.2014.08.007 BindingDB Entry DOI: 10.7270/Q22Z146M
					More data for this Ligand-Target Pair