BDBM249699 US9447038, 127

SMILES: COc1cc(CN(CC2CCCC2)C(CC(O)=O)c2ccc3OCCc3c2)ccc1OCCn1c(=O)ccn(C)c1=O

InChI Key: InChIKey=CIDBZTRWEVTAGN-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 = 249699   

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
C-X-C motif chemokine 10 (CXCL10) (Homo sapiens (Human))	BDBM249699 (US9447038, 127) Show SMILES COc1cc(CN(CC2CCCC2)C(CC(O)=O)c2ccc3OCCc3c2)ccc1OCCn1c(=O)ccn(C)c1=O Show InChI InChI=1S/C32H39N3O7/c1-33-13-11-30(36)35(32(33)39)14-16-42-28-9-7-23(17-29(28)40-2)21-34(20-22-5-3-4-6-22)26(19-31(37)38)24-8-10-27-25(18-24)12-15-41-27/h7-11,13,17-18,22,26H,3-6,12,14-16,19-21H2,1-2H3,(H,37,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	25
Sanofi US Patent					Assay Description The composition of the binding assay buffer is determined in a course of detailed optimization procedure. This resulted in a binding assay buffer con...				US Patent US9447038 (2016) BindingDB Entry DOI: 10.7270/Q29G5KQK
					More data for this Ligand-Target Pair