BDBM51884 2-(diethylamino)ethyl 4-[[(Z)-2-cyano-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate::4-[[(Z)-2-cyano-2-[4-(3-methoxyphenyl)-2-thiazolyl]ethenyl]amino]benzoic acid 2-(diethylamino)ethyl ester::4-[[(Z)-2-cyano-2-[4-(3-methoxyphenyl)thiazol-2-yl]vinyl]amino]benzoic acid 2-(diethylamino)ethyl ester::4-{(Z)-2-Cyano-2-[4-(3-methoxy-phenyl)-thiazol-2-yl]-vinylamino}-benzoic acid 2-diethylamino-ethyl ester::MLS000769347::SMR000434081::cid_1833916

SMILES: CCN(CC)CCOC(=O)c1ccc(cc1)N=CC(C#N)c1nc(cs1)-c1cccc(OC)c1

InChI Key: InChIKey=NICQRUSXMHKTMR-UHFFFAOYSA-N

Data: 3 IC50  2 EC50

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 5 hits for monomerid = 51884   

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
Mitogen-activated protein kinase kinase kinase kinase 2 (Homo sapiens (Human))	BDBM51884 (2-(diethylamino)ethyl 4-[[(Z)-2-cyano-2-[4-(3-meth...) Show SMILES CCN(CC)CCOC(=O)c1ccc(cc1)N=CC(C#N)c1nc(cs1)-c1cccc(OC)c1 |w:16.16| Show InChI InChI=1S/C26H28N4O3S/c1-4-30(5-2)13-14-33-26(31)19-9-11-22(12-10-19)28-17-21(16-27)25-29-24(18-34-25)20-7-6-8-23(15-20)32-3/h6-12,15,17-18,21H,4-5,13-14H2,1-3H3	MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: 1R03MH084830-01 Project Title: TR-FRET HTS Assay for Inhibitors of MEKK2-MEK5 PB1 Domain...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q25Q4THK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase kinase 2 (Homo sapiens (Human))	BDBM51884 (2-(diethylamino)ethyl 4-[[(Z)-2-cyano-2-[4-(3-meth...) Show SMILES CCN(CC)CCOC(=O)c1ccc(cc1)N=CC(C#N)c1nc(cs1)-c1cccc(OC)c1 |w:16.16| Show InChI InChI=1S/C26H28N4O3S/c1-4-30(5-2)13-14-33-26(31)19-9-11-22(12-10-19)28-17-21(16-27)25-29-24(18-34-25)20-7-6-8-23(15-20)32-3/h6-12,15,17-18,21H,4-5,13-14H2,1-3H3	MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: 1R03MH084830-01 Project Title: TR-FRET HTS Assay for Inhibitors of MEKK2-MEK5 PB1 Domain...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q21Z42TP
					More data for this Ligand-Target Pair
XBP1 (Homo sapiens (Human))	BDBM51884 (2-(diethylamino)ethyl 4-[[(Z)-2-cyano-2-[4-(3-meth...) Show SMILES CCN(CC)CCOC(=O)c1ccc(cc1)N=CC(C#N)c1nc(cs1)-c1cccc(OC)c1 |w:16.16| Show InChI InChI=1S/C26H28N4O3S/c1-4-30(5-2)13-14-33-26(31)19-9-11-22(12-10-19)28-17-21(16-27)25-29-24(18-34-25)20-7-6-8-23(15-20)32-3/h6-12,15,17-18,21H,4-5,13-14H2,1-3H3	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.18E+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: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2NK3CGB
					More data for this Ligand-Target Pair
DNA damage-inducible transcript 3 protein (Mus musculus)	BDBM51884 (2-(diethylamino)ethyl 4-[[(Z)-2-cyano-2-[4-(3-meth...) Show SMILES CCN(CC)CCOC(=O)c1ccc(cc1)N=CC(C#N)c1nc(cs1)-c1cccc(OC)c1 |w:16.16| Show InChI InChI=1S/C26H28N4O3S/c1-4-30(5-2)13-14-33-26(31)19-9-11-22(12-10-19)28-17-21(16-27)25-29-24(18-34-25)20-7-6-8-23(15-20)32-3/h6-12,15,17-18,21H,4-5,13-14H2,1-3H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	9.34E+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: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q28C9TQN
					More data for this Ligand-Target Pair
DNA damage-inducible transcript 3 protein (Mus musculus)	BDBM51884 (2-(diethylamino)ethyl 4-[[(Z)-2-cyano-2-[4-(3-meth...) Show SMILES CCN(CC)CCOC(=O)c1ccc(cc1)N=CC(C#N)c1nc(cs1)-c1cccc(OC)c1 |w:16.16| Show InChI InChI=1S/C26H28N4O3S/c1-4-30(5-2)13-14-33-26(31)19-9-11-22(12-10-19)28-17-21(16-27)25-29-24(18-34-25)20-7-6-8-23(15-20)32-3/h6-12,15,17-18,21H,4-5,13-14H2,1-3H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	9.34E+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: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2PC30VZ
					More data for this Ligand-Target Pair