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BDBM373630 US10604535, Example 114A::US9896458, No. 114A

SMILES: CN1c2cnn(C)c2CC[C@H](NC(=O)c2nn(Cc3ccccc3)cc2F)C1=O

InChI Key: InChIKey=NKIKYIKDZGIZOR-HNNXBMFYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 373630   
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
Receptor-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM373630
PNG
(US10604535, Example 114A | US9896458, No. 114A)
Show SMILES CN1c2cnn(C)c2CC[C@H](NC(=O)c2nn(Cc3ccccc3)cc2F)C1=O |r|
Show InChI InChI=1S/C20H21FN6O2/c1-25-17-10-22-26(2)16(17)9-8-15(20(25)29)23-19(28)18-14(21)12-27(24-18)11-13-6-4-3-5-7-13/h3-7,10,12,15H,8-9,11H2,1-2H3,(H,23,28)/t15-/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+3n/an/an/an/an/an/a



Denali Therapeutics Inc.

US Patent


Assay Description
Fluorescent polarization binding assay was performed in polystyrene low volume 384-well black plate, at Room Temperature (RT) in a final volume of 10...


US Patent US10604535 (2020)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM373630
PNG
(US10604535, Example 114A | US9896458, No. 114A)
Show SMILES CN1c2cnn(C)c2CC[C@H](NC(=O)c2nn(Cc3ccccc3)cc2F)C1=O |r|
Show InChI InChI=1S/C20H21FN6O2/c1-25-17-10-22-26(2)16(17)9-8-15(20(25)29)23-19(28)18-14(21)12-27(24-18)11-13-6-4-3-5-7-13/h3-7,10,12,15H,8-9,11H2,1-2H3,(H,23,28)/t15-/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 500n/an/an/an/an/an/a



University of Mississippi



Assay Description
Test compounds were diluted in DMSO and 0.1 μL of solution was dispensed to each well of a 384-well white solid microplate. The assay buffer was...


J Med Chem 48: 2906-15 (2005)


BindingDB Entry DOI: 10.7270/Q2XW4N44
More data for this
Ligand-Target Pair