BDBM50446828 CHEMBL3115049

SMILES: COc1cccc2OCCCCOc3cccc(C[C@H](NC(=O)c12)C(O)=O)c3

InChI Key: InChIKey=ULDSWDVLXWPZAV-INIZCTEOSA-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 = 50446828   

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
Integrin alpha2/beta1 (Homo sapiens (Human))	BDBM50446828 (CHEMBL3115049) Show SMILES COc1cccc2OCCCCOc3cccc(C[C@H](NC(=O)c12)C(O)=O)c3 |r| Show InChI InChI=1S/C21H23NO6/c1-26-17-8-5-9-18-19(17)20(23)22-16(21(24)25)13-14-6-4-7-15(12-14)27-10-2-3-11-28-18/h4-9,12,16H,2-3,10-11,13H2,1H3,(H,22,23)(H,24,25)/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi R&D Curated by ChEMBL					Assay Description Antagonist activity at recombinant integrin alpha2 beta1 receptor (unknown origin) assessed as inhibition of interaction with biotinylated collagen t...				ACS Med Chem Lett 5: 193-8 (2014) Article DOI: 10.1021/ml4004556 BindingDB Entry DOI: 10.7270/Q2P84DDF
					More data for this Ligand-Target Pair