BDBM50543113 CHEMBL4643988

SMILES: CC(=O)ON1CCCC(C1=O)P(=O)(NCc1ccccc1)OCc1ccc(o1)[N+]([O-])=O

InChI Key: InChIKey=BOKBRERPSDJBSI-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50543113   

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
Enolase 1 (ENO1) (Homo sapiens (Human))	BDBM50543113 (CHEMBL4643988) Show SMILES CC(=O)ON1CCCC(C1=O)P(=O)(NCc1ccccc1)OCc1ccc(o1)[N+]([O-])=O Show InChI InChI=1S/C19H22N3O8P/c1-14(23)30-21-11-5-8-17(19(21)24)31(27,20-12-15-6-3-2-4-7-15)28-13-16-9-10-18(29-16)22(25)26/h2-4,6-7,9-10,17H,5,8,11-13H2,1H3,(H,20,27)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	2.59E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas MD Anderson Cancer Center Curated by ChEMBL					Assay Description Inhibition of ENO1 in overexpressed human D423 cells incubated for 5 days in presence of 21 % oxygen by crystal violet staining based spectrophotomet...				ACS Med Chem Lett 11: 1484-1489 (2020)
					More data for this Ligand-Target Pair
Enolase 1 (ENO1) (Homo sapiens (Human))	BDBM50543113 (CHEMBL4643988) Show SMILES CC(=O)ON1CCCC(C1=O)P(=O)(NCc1ccccc1)OCc1ccc(o1)[N+]([O-])=O Show InChI InChI=1S/C19H22N3O8P/c1-14(23)30-21-11-5-8-17(19(21)24)31(27,20-12-15-6-3-2-4-7-15)28-13-16-9-10-18(29-16)22(25)26/h2-4,6-7,9-10,17H,5,8,11-13H2,1H3,(H,20,27)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	7.84E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas MD Anderson Cancer Center Curated by ChEMBL					Assay Description Inhibition of ENO1 in wild-type human LN319 cells incubated for 5 days in presence of 1 % oxygen by crystal violet staining based spectrophotometry				ACS Med Chem Lett 11: 1484-1489 (2020)
					More data for this Ligand-Target Pair
Enolase 1 (ENO1) (Homo sapiens (Human))	BDBM50543113 (CHEMBL4643988) Show SMILES CC(=O)ON1CCCC(C1=O)P(=O)(NCc1ccccc1)OCc1ccc(o1)[N+]([O-])=O Show InChI InChI=1S/C19H22N3O8P/c1-14(23)30-21-11-5-8-17(19(21)24)31(27,20-12-15-6-3-2-4-7-15)28-13-16-9-10-18(29-16)22(25)26/h2-4,6-7,9-10,17H,5,8,11-13H2,1H3,(H,20,27)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	5.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas MD Anderson Cancer Center Curated by ChEMBL					Assay Description Inhibition of ENO1 in overexpressed human D423 cells incubated for 5 days in presence of 1 % oxygen by crystal violet staining based spectrophotometr...				ACS Med Chem Lett 11: 1484-1489 (2020)
					More data for this Ligand-Target Pair
Enolase 1 (ENO1) (Homo sapiens (Human))	BDBM50543113 (CHEMBL4643988) Show SMILES CC(=O)ON1CCCC(C1=O)P(=O)(NCc1ccccc1)OCc1ccc(o1)[N+]([O-])=O Show InChI InChI=1S/C19H22N3O8P/c1-14(23)30-21-11-5-8-17(19(21)24)31(27,20-12-15-6-3-2-4-7-15)28-13-16-9-10-18(29-16)22(25)26/h2-4,6-7,9-10,17H,5,8,11-13H2,1H3,(H,20,27)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	2.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas MD Anderson Cancer Center Curated by ChEMBL					Assay Description Inhibition of ENO1 in wild-type human LN319 cells incubated for 5 days in presence of 21 % oxygen by crystal violet staining based spectrophotometry				ACS Med Chem Lett 11: 1484-1489 (2020)
					More data for this Ligand-Target Pair