BDBM223204 8-((6-((5-Methoxy-1H-benzo[d]imidazol-2-yl)thio)pyrimidin-4-yl)oxy)quinoline (Molecule 2)

SMILES: COc1ccc2[nH]c(Sc3cc(Oc4cccc5cccnc45)ncn3)nc2c1

InChI Key: InChIKey=PUAWDLANHACSIF-UHFFFAOYSA-N

Data: 1 KI

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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 = 223204   

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
Calcium/calmodulin- dependent protein kinase IV (CAMKIV) (Homo sapiens (Human))	BDBM223204 (8-((6-((5-Methoxy-1H-benzo[d]imidazol-2-yl)thio)py...) Show SMILES COc1ccc2[nH]c(Sc3cc(Oc4cccc5cccnc45)ncn3)nc2c1 Show InChI InChI=1S/C21H15N5O2S/c1-27-14-7-8-15-16(10-14)26-21(25-15)29-19-11-18(23-12-24-19)28-17-6-2-4-13-5-3-9-22-20(13)17/h2-12H,1H3,(H,25,26)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.44E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
B.R. Ambedkar Bihar University					Assay Description The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...				Chem Biol Drug Des 89: 741-754 (2017) Article DOI: 10.1111/cbdd.12898 BindingDB Entry DOI: 10.7270/Q28C9V30
					More data for this Ligand-Target Pair