BDBM50435621 CHEMBL2391190

SMILES: OC(=O)C1CCN(CC1)c1ccc(cc1)N1C[C@H](CNCc2ccc(cc2)-c2nc(=O)o[nH]2)OC1=O

InChI Key: InChIKey=FJUJZGZXOCKUHP-NRFANRHFSA-N

Data: 1 KI  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 2 hits for monomerid = 50435621   

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
Coagulation factor X (Homo sapiens (Human))	BDBM50435621 (CHEMBL2391190) Show SMILES OC(=O)C1CCN(CC1)c1ccc(cc1)N1C[C@H](CNCc2ccc(cc2)-c2nc(=O)o[nH]2)OC1=O |r| Show InChI InChI=1S/C25H27N5O6/c31-23(32)18-9-11-29(12-10-18)19-5-7-20(8-6-19)30-15-21(35-25(30)34)14-26-13-16-1-3-17(4-2-16)22-27-24(33)36-28-22/h1-8,18,21,26H,9-15H2,(H,31,32)(H,27,28,33)/t21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of F10a (unknown origin) using S-2222 as substrate incubated for 15 mins prior to substrate addition measured every 10 secs by spectrophot...				Eur J Med Chem 64: 302-13 (2013) Article DOI: 10.1016/j.ejmech.2013.03.056 BindingDB Entry DOI: 10.7270/Q2Q241N8
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50435621 (CHEMBL2391190) Show SMILES OC(=O)C1CCN(CC1)c1ccc(cc1)N1C[C@H](CNCc2ccc(cc2)-c2nc(=O)o[nH]2)OC1=O |r| Show InChI InChI=1S/C25H27N5O6/c31-23(32)18-9-11-29(12-10-18)19-5-7-20(8-6-19)30-15-21(35-25(30)34)14-26-13-16-1-3-17(4-2-16)22-27-24(33)36-28-22/h1-8,18,21,26H,9-15H2,(H,31,32)(H,27,28,33)/t21-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Displacement of biotinylated fibrinogen from human glycoprotein 2b/3a receptor after 2 hrs by chemiluminescence assay				Eur J Med Chem 64: 302-13 (2013) Article DOI: 10.1016/j.ejmech.2013.03.056 BindingDB Entry DOI: 10.7270/Q2Q241N8
					More data for this Ligand-Target Pair