BDBM367630 N-((1R,2R)-3-(azetidin-1-yl)-1-(4- cyclopropoxy-3-fluorophenyl)-1- hydroxypropan-2-yl)-7-chloro-1H- benzo[4,5]thieno[2,3-d][1,2]oxazine- 4-carboxamide::US10227312, Example 15::US10759769, Example 15

SMILES: O[C@@H]([C@@H](CN1CCC1)NC(=O)C1=NOCc2c1sc1cc(Cl)ccc21)c1ccc(OC2CC2)c(F)c1

InChI Key: InChIKey=TXAGIPHWNXGVRZ-HYBUGGRVSA-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 = 367630   

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
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM367630 (N-((1R,2R)-3-(azetidin-1-yl)-1-(4- cyclopropoxy-3-...) Show SMILES O[C@@H]([C@@H](CN1CCC1)NC(=O)C1=NOCc2c1sc1cc(Cl)ccc21)c1ccc(OC2CC2)c(F)c1 |r,t:12| Show InChI InChI=1S/C26H25ClFN3O4S/c27-15-3-6-17-18-13-34-30-23(25(18)36-22(17)11-15)26(33)29-20(12-31-8-1-9-31)24(32)14-2-7-21(19(28)10-14)35-16-4-5-16/h2-3,6-7,10-11,16,20,24,32H,1,4-5,8-9,12-13H2,(H,29,33)/t20-,24-/m1/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
TBA US Patent					Assay Description Protein concentration was determined using BCA assay kit. Sixty micrograms of MDCK cell lysate was incubated with various concentrations of a compoun...				US Patent US10759769 (2020)
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM367630 (N-((1R,2R)-3-(azetidin-1-yl)-1-(4- cyclopropoxy-3-...) Show SMILES O[C@@H]([C@@H](CN1CCC1)NC(=O)C1=NOCc2c1sc1cc(Cl)ccc21)c1ccc(OC2CC2)c(F)c1 |r,t:12| Show InChI InChI=1S/C26H25ClFN3O4S/c27-15-3-6-17-18-13-34-30-23(25(18)36-22(17)11-15)26(33)29-20(12-31-8-1-9-31)24(32)14-2-7-21(19(28)10-14)35-16-4-5-16/h2-3,6-7,10-11,16,20,24,32H,1,4-5,8-9,12-13H2,(H,29,33)/t20-,24-/m1/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research					Assay Description This assay was modified based on the study by Larsen et al. (J. Lipid Res. 2011, 53, 282). Madin-Darby canine kidney (MDCK) cell lysate was prepared ...				J Med Chem 51: 1319-23 (2008) BindingDB Entry DOI: 10.7270/Q2G44SK0
					More data for this Ligand-Target Pair