BDBM333564 (S)-1-(5-tert- butylisoxazol- 3-yl)-3-(3- (6-(1-(2,2- difluoroethyl) pyrrolidin- 3-yloxy)-7- methoxy- quinazolin- 4- yloxy)phenyl) urea::US9730937, Example 110

SMILES COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(on4)C(C)(C)C)c3)c2cc1O[C@H]1CCN(CC(F)F)C1

InChI Key InChIKey=JGHAMHPTTPGUNY-UHFFFAOYSA-N

Data  3 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 333564   

TargetSerine/threonine-protein kinase B-raf [V600E](Human)
Ambit Biosciences

US Patent
LigandChemical structure of BindingDB Monomer ID 333564BDBM333564((S)-1-(5-tert- butylisoxazol- 3-yl)-3-(3- (6-(1-(2...)
Affinity DataKd: <250nMAssay Description:Competition binding assays used herein were developed, validated and performed as described in Fabian et al., Nature Biotechnology 2005, 23, 329-336....More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/23/2019
Entry Details
US Patent

TargetRAF proto-oncogene serine/threonine-protein kinase(Human)
Ambit Biosciences

US Patent
LigandChemical structure of BindingDB Monomer ID 333564BDBM333564((S)-1-(5-tert- butylisoxazol- 3-yl)-3-(3- (6-(1-(2...)
Affinity DataKd: <250nMAssay Description:Competition binding assays used herein were developed, validated and performed as described in Fabian et al., Nature Biotechnology 2005, 23, 329-336....More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/23/2019
Entry Details
US Patent

TargetSerine/threonine-protein kinase B-raf(Human)
Ambit Biosciences

US Patent
LigandChemical structure of BindingDB Monomer ID 333564BDBM333564((S)-1-(5-tert- butylisoxazol- 3-yl)-3-(3- (6-(1-(2...)
Affinity DataKd:  375nMAssay Description:Competition binding assays used herein were developed, validated and performed as described in Fabian et al., Nature Biotechnology 2005, 23, 329-336....More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/23/2019
Entry Details
US Patent