BDBM50425877 CHEMBL2312658

SMILES: COc1ccccc1CNc1ncc(C(=O)NCCCO)c(NC2CCCC2)n1

InChI Key: InChIKey=LXSBESSANKCKCG-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 = 50425877   

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
Tyrosine-protein kinase receptor TYRO3 (Homo sapiens (Human))	BDBM50425877 (CHEMBL2312658) Show SMILES COc1ccccc1CNc1ncc(C(=O)NCCCO)c(NC2CCCC2)n1 Show InChI InChI=1S/C21H29N5O3/c1-29-18-10-5-2-7-15(18)13-23-21-24-14-17(20(28)22-11-6-12-27)19(26-21)25-16-8-3-4-9-16/h2,5,7,10,14,16,27H,3-4,6,8-9,11-13H2,1H3,(H,22,28)(H2,23,24,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of Sky (unknown origin) by ELISA kinase assay in presence of 60 uM ATP				Bioorg Med Chem Lett 23: 1051-5 (2013) Article DOI: 10.1016/j.bmcl.2012.12.028 BindingDB Entry DOI: 10.7270/Q2XW4M38
					More data for this Ligand-Target Pair
P-selectin/P-selectin glycoprotein ligand 1 (Homo sapiens (Human))	BDBM50425877 (CHEMBL2312658) Show SMILES COc1ccccc1CNc1ncc(C(=O)NCCCO)c(NC2CCCC2)n1 Show InChI InChI=1S/C21H29N5O3/c1-29-18-10-5-2-7-15(18)13-23-21-24-14-17(20(28)22-11-6-12-27)19(26-21)25-16-8-3-4-9-16/h2,5,7,10,14,16,27H,3-4,6,8-9,11-13H2,1H3,(H,22,28)(H2,23,24,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of P-selectin aggregation in platelet surface (unknown origin)				Bioorg Med Chem Lett 23: 1051-5 (2013) Article DOI: 10.1016/j.bmcl.2012.12.028 BindingDB Entry DOI: 10.7270/Q2XW4M38
					More data for this Ligand-Target Pair