BDBM50785 1-[3-[1-cyano-2-oxo-2-[(phenylmethyl)amino]ethyl]-2-quinoxalinyl]-3-piperidinecarboxylic acid ethyl ester::1-[3-[2-(benzylamino)-1-cyano-2-keto-ethyl]quinoxalin-2-yl]nipecotic acid ethyl ester::MLS000079951::SMR000041144::cid_660313::ethyl 1-[3-[1-cyano-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]quinoxalin-2-yl]piperidine-3-carboxylate::ethyl 1-[3-[2-(benzylamino)-1-cyano-2-oxoethyl]quinoxalin-2-yl]piperidine-3-carboxylate

SMILES: CCOC(=O)C1CCCN(C1)c1nc2ccccc2nc1C(C#N)C(=O)NCc1ccccc1

InChI Key: InChIKey=IUMXMQSPIMHHAM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50785   

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
Glycoprotein 42 (Human herpesvirus 4 type 2)	BDBM50785 (1-[3-[1-cyano-2-oxo-2-[(phenylmethyl)amino]ethyl]-...) Show SMILES CCOC(=O)C1CCCN(C1)c1nc2ccccc2nc1C(C#N)C(=O)NCc1ccccc1 Show InChI InChI=1S/C26H27N5O3/c1-2-34-26(33)19-11-8-14-31(17-19)24-23(29-21-12-6-7-13-22(21)30-24)20(15-27)25(32)28-16-18-9-4-3-5-10-18/h3-7,9-10,12-13,19-20H,2,8,11,14,16-17H2,1H3,(H,28,32)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	4.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2057DCW
					More data for this Ligand-Target Pair
PC4 and SFRS1-interacting protein (Homo sapiens (Human))	BDBM50785 (1-[3-[1-cyano-2-oxo-2-[(phenylmethyl)amino]ethyl]-...) Show SMILES CCOC(=O)C1CCCN(C1)c1nc2ccccc2nc1C(C#N)C(=O)NCc1ccccc1 Show InChI InChI=1S/C26H27N5O3/c1-2-34-26(33)19-11-8-14-31(17-19)24-23(29-21-12-6-7-13-22(21)30-24)20(15-27)25(32)28-16-18-9-4-3-5-10-18/h3-7,9-10,12-13,19-20H,2,8,11,14,16-17H2,1H3,(H,28,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: Ohio State University Assay Provider: Mam...				PubChem Bioassay (2014) BindingDB Entry DOI: 10.7270/Q2KD1WKS
					More data for this Ligand-Target Pair
PC4 and SFRS1-interacting protein (Homo sapiens (Human))	BDBM50785 (1-[3-[1-cyano-2-oxo-2-[(phenylmethyl)amino]ethyl]-...) Show SMILES CCOC(=O)C1CCCN(C1)c1nc2ccccc2nc1C(C#N)C(=O)NCc1ccccc1 Show InChI InChI=1S/C26H27N5O3/c1-2-34-26(33)19-11-8-14-31(17-19)24-23(29-21-12-6-7-13-22(21)30-24)20(15-27)25(32)28-16-18-9-4-3-5-10-18/h3-7,9-10,12-13,19-20H,2,8,11,14,16-17H2,1H3,(H,28,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: Ohio State University Assay Provider: Mam...				PubChem Bioassay (2014) BindingDB Entry DOI: 10.7270/Q2Q52N9H
					More data for this Ligand-Target Pair