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BDBM205715 US9255090, 184

SMILES: COc1cc(CC(O)=O)ccc1-c1ccc(F)c2CCN(Cc12)C(=O)[C@@H]1C[C@H]1c1ccccc1

InChI Key: InChIKey=PJDJLXTZYRHZRB-XZOQPEGZSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 205715   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM205715
PNG
(US9255090, 184)
Show SMILES COc1cc(CC(O)=O)ccc1-c1ccc(F)c2CCN(Cc12)C(=O)[C@@H]1C[C@H]1c1ccccc1
Show InChI InChI=1S/C28H26FNO4/c1-34-26-13-17(14-27(31)32)7-8-21(26)19-9-10-25(29)20-11-12-30(16-24(19)20)28(33)23-15-22(23)18-5-3-2-4-6-18/h2-10,13,22-23H,11-12,14-16H2,1H3,(H,31,32)/t22-,23+/m0/s1
PDB

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PC cid
PC sid
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US Patent
n/an/a 0.900n/an/an/an/a7.025



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
Binding assay was performed in a final assay volume of 250 ul. First, 25 ul of test compound, previously diluted in Binding-Buffer (Binding-Buffer: 5...


US Patent US9255090 (2016)


BindingDB Entry DOI: 10.7270/Q2TQ60B2
More data for this
Ligand-Target Pair