BDBM549905 (3S,4S)-1-((1RS)-2,2-Difluoro-cyclopropylmethyl)-4-{[5-(2,4-difluoro- phenyl)-isoxazole-3-carbonyl]-amino}-piperidine-3-carboxylic acid (1- pyrimidin-2-yl-cyclopropyl)-amide (mixture of isomers)::US11306078, Example 2.084

SMILES Fc1ccc(-c2cc(no2)C(=O)N[C@H]2CCN(CC3CC3(F)F)C[C@@H]2C(=O)NC2(CC2)c2ncccn2)c(F)c1

InChI Key InChIKey=IQEIMOLZVPNHHL-AKPNPTIESA-N

Data  1 IC50

  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 1 hit for monomerid = 549905   

TargetAtypical chemokine receptor 3(Homo sapiens (Human))
Idorsia Pharmaceuticals

US Patent
LigandPNGBDBM549905((3S,4S)-1-((1RS)-2,2-Difluoro-cyclopropylmethyl)-4...)
Affinity DataIC50:  8nMAssay Description:Tango CXCR7-bla U2OS cells are detached from culture dishes with 0.05% trypsin-EDTA and collected in growing medium (McCoy's 5A 90% (v/v), dialyz...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent