BDBM50303097 3-(7-(8-azabicyclo[3.2.1]octan-3-yl)-2-(pyridin-4-yl)-1,2-dihydropyrazolo[1,5-a]pyrimidin-3-yl)phenol::CHEMBL583025

SMILES: Oc1cccc(c1)-c1c(nn2c(ccnc12)C1CC2CCC(C1)N2)-c1ccncc1

InChI Key: InChIKey=XDBBGTIPWPBPQD-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50303097   

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
Serine/threonine-protein kinase B-raf (Homo sapiens (Human))	BDBM50303097 (3-(7-(8-azabicyclo[3.2.1]octan-3-yl)-2-(pyridin-4-...) Show SMILES Oc1cccc(c1)-c1c(nn2c(ccnc12)C1CC2CCC(C1)N2)-c1ccncc1 |TLB:11:16:23:19.20| Show InChI InChI=1S/C24H23N5O/c30-20-3-1-2-16(14-20)22-23(15-6-9-25-10-7-15)28-29-21(8-11-26-24(22)29)17-12-18-4-5-19(13-17)27-18/h1-3,6-11,14,17-19,27,30H,4-5,12-13H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of B-Raf				Bioorg Med Chem Lett 19: 6957-61 (2009) Article DOI: 10.1016/j.bmcl.2009.10.058 BindingDB Entry DOI: 10.7270/Q2833S34
					More data for this Ligand-Target Pair