BDBM50303119 3-(1H-indazol-4-yl)-7-(8-isopropyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(pyridin-4-yl)-1,2-dihydropyrazolo[1,5-a]pyrimidine::CHEMBL570648

SMILES: CC(C)N1C2CCC1CC(C2)c1ccnc2c(c(nn12)-c1ccncc1)-c1cccc2[nH]ncc12

InChI Key: InChIKey=XSRXVRQXSQUEKK-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50303119   

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))	BDBM50303119 (3-(1H-indazol-4-yl)-7-(8-isopropyl-8-azabicyclo[3....) Show SMILES CC(C)N1C2CCC1CC(C2)c1ccnc2c(c(nn12)-c1ccncc1)-c1cccc2[nH]ncc12 |THB:11:9:3:5.6,(-4.36,3.26,;-5.68,2.47,;-7.03,3.22,;-5.65,.93,;-6.19,-.53,;-7.71,-1.21,;-6.34,-1.18,;-5.15,-.32,;-3.61,-1.16,;-4.15,-2.63,;-4.59,-1.45,;-4.15,-4.17,;-5.47,-4.94,;-5.48,-6.49,;-4.14,-7.26,;-2.81,-6.49,;-1.34,-6.96,;-.43,-5.71,;-1.34,-4.46,;-2.81,-4.94,;1.11,-5.71,;1.88,-7.04,;3.41,-7.04,;4.18,-5.71,;3.41,-4.37,;1.87,-4.38,;-1.27,-8.5,;-2.57,-9.32,;-2.51,-10.86,;-1.15,-11.58,;.16,-10.76,;1.66,-11.17,;2.51,-9.88,;1.54,-8.66,;.09,-9.21,)| Show InChI InChI=1S/C28H29N7/c1-17(2)34-20-6-7-21(34)15-19(14-20)25-10-13-30-28-26(22-4-3-5-24-23(22)16-31-32-24)27(33-35(25)28)18-8-11-29-12-9-18/h3-5,8-13,16-17,19-21H,6-7,14-15H2,1-2H3,(H,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	67	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