BDBM59124 Hymenialdisine, 28I

SMILES: Brc1[nH]c2c(c1Br)C(CCNC2=O)=NNc1cccnc1

InChI Key: InChIKey=HLRLQPWXEBLKOB-UHFFFAOYSA-N

Data: 2 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 = 59124   

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
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM59124 (Hymenialdisine, 28I) Show SMILES Brc1[nH]c2c(c1Br)C(CCNC2=O)=NNc1cccnc1 |w:13.15| Show InChI InChI=1S/C13H11Br2N5O/c14-10-9-8(20-19-7-2-1-4-16-6-7)3-5-17-13(21)11(9)18-12(10)15/h1-2,4,6,18-19H,3,5H2,(H,17,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.23E+4	n/a	n/a	n/a	n/a	7.2	n/a
Genomics Institute of the Novartis Research Foundation					Assay Description In vitro kinase assay using SPA assay kit from Amersham Pharmacia Biotech, Uk.				Chem Biol 11: 247-59 (2004) Article DOI: 10.1016/j.chembiol.2004.01.015 BindingDB Entry DOI: 10.7270/Q2FN14M9
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 5 regulatory subunit 1 (Homo sapiens (Human))	BDBM59124 (Hymenialdisine, 28I) Show SMILES Brc1[nH]c2c(c1Br)C(CCNC2=O)=NNc1cccnc1 |w:13.15| Show InChI InChI=1S/C13H11Br2N5O/c14-10-9-8(20-19-7-2-1-4-16-6-7)3-5-17-13(21)11(9)18-12(10)15/h1-2,4,6,18-19H,3,5H2,(H,17,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.42E+3	n/a	n/a	n/a	n/a	7.2	n/a
Genomics Institute of the Novartis Research Foundation					Assay Description In vitro kinase assay using SPA assay kit from Amersham Pharmacia Biotech, Uk.				Chem Biol 11: 247-59 (2004) Article DOI: 10.1016/j.chembiol.2004.01.015 BindingDB Entry DOI: 10.7270/Q2FN14M9
					More data for this Ligand-Target Pair