BDBM307745 5-chloro-N-[2-(1-ethylpiperidin-4-yl)ethyl]-4-[1-(3-fluorobenzyl)-1H-benzimidazol-6-yl]pyridin-2-amine::US9650358, Example 41

SMILES: CCN1CCC(CCNc2cc(c(Cl)cn2)-c2ccc3ncn(Cc4cccc(F)c4)c3c2)CC1

InChI Key: InChIKey=HTQLYKYZIANBAW-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 = 307745   

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
Cyclin-dependent kinase 9 (Homo sapiens (Human))	BDBM307745 (5-chloro-N-[2-(1-ethylpiperidin-4-yl)ethyl]-4-[1-(...) Show SMILES CCN1CCC(CCNc2cc(c(Cl)cn2)-c2ccc3ncn(Cc4cccc(F)c4)c3c2)CC1 Show InChI InChI=1S/C28H31ClFN5/c1-2-34-12-9-20(10-13-34)8-11-31-28-16-24(25(29)17-32-28)22-6-7-26-27(15-22)35(19-33-26)18-21-4-3-5-23(30)14-21/h3-7,14-17,19-20H,2,8-13,18H2,1H3,(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
AbbVie Inc. US Patent					Assay Description CDK9 enzyme activities were measured using LANCE ULight TR-FRET kinase assay reagents (PerkinElmer, Waltham, Mass.). Compounds were directly added in...				US Patent US9650358 (2017) BindingDB Entry DOI: 10.7270/Q2057J0M
					More data for this Ligand-Target Pair