BDBM50176807 CHEMBL3808658

SMILES: OC(=O)c1ccc(Cl)cc1-c1ccc(\C=C2/C(=O)N(N=C2c2ccccc2)c2ccc(F)cc2)o1

InChI Key: InChIKey=YQHUXSFPUWHNEN-HAHDFKILSA-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 = 50176807   

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
Neuraminidase (Influenza A virus)	BDBM50176807 (CHEMBL3808658) Show SMILES OC(=O)c1ccc(Cl)cc1-c1ccc(\C=C2/C(=O)N(N=C2c2ccccc2)c2ccc(F)cc2)o1 |c:20| Show InChI InChI=1S/C27H16ClFN2O4/c28-17-6-12-21(27(33)34)22(14-17)24-13-11-20(35-24)15-23-25(16-4-2-1-3-5-16)30-31(26(23)32)19-9-7-18(29)8-10-19/h1-15H,(H,33,34)/b23-15-	PDB MMDB B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academia Sinica Curated by ChEMBL					Assay Description Inhibition of Influenza A virus H5N1 neuraminidase preincubated for 10 mins followed by addition of 2'-(4-methylumbelliferyl)-alpha-D-N-acetylneurami...				Bioorg Med Chem 24: 3035-3042 (2016) BindingDB Entry DOI: 10.7270/Q2ZK5JK9
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (Human SARS coronavirus (SARS-CoV) (Severe acute re...)	BDBM50176807 (CHEMBL3808658) Show SMILES OC(=O)c1ccc(Cl)cc1-c1ccc(\C=C2/C(=O)N(N=C2c2ccccc2)c2ccc(F)cc2)o1 |c:20| Show InChI InChI=1S/C27H16ClFN2O4/c28-17-6-12-21(27(33)34)22(14-17)24-13-11-20(35-24)15-23-25(16-4-2-1-3-5-16)30-31(26(23)32)19-9-7-18(29)8-10-19/h1-15H,(H,33,34)/b23-15-	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
Academia Sinica Curated by ChEMBL					Assay Description Inhibition of SARS coronavirus recombinant 3CL-PRO expressed in Escherichia coli JM109 cells using Dabcyl-KTSAVLQSGFRKME-Edans as fluorogenic substra...				Bioorg Med Chem 24: 3035-3042 (2016) BindingDB Entry DOI: 10.7270/Q2ZK5JK9
					More data for this Ligand-Target Pair