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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Receptor-interacting serine/threonine-protein kinase 1' and Ligand = 'BDBM356486'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM356486
PNG
(US10604535, Example 221 | US9815850, Compound 221 ...)
Show SMILES C[C@H]1Oc2cccnc2N(C)C(=O)[C@H]1NC(=O)c1nnc(o1)C(F)(F)c1ccccc1 |r|
Show InChI InChI=1S/C20H17F2N5O4/c1-11-14(18(29)27(2)15-13(30-11)9-6-10-23-15)24-16(28)17-25-26-19(31-17)20(21,22)12-7-4-3-5-8-12/h3-11,14H,1-2H3,(H,24,28)/t11-,14+/m1/s1
PDB

UniProtKB/SwissProt

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
Receptor-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM356486
PNG
(US10604535, Example 221 | US9815850, Compound 221 ...)
Show SMILES C[C@H]1Oc2cccnc2N(C)C(=O)[C@H]1NC(=O)c1nnc(o1)C(F)(F)c1ccccc1 |r|
Show InChI InChI=1S/C20H17F2N5O4/c1-11-14(18(29)27(2)15-13(30-11)9-6-10-23-15)24-16(28)17-25-26-19(31-17)20(21,22)12-7-4-3-5-8-12/h3-11,14H,1-2H3,(H,24,28)/t11-,14+/m1/s1
PDB

UniProtKB/SwissProt

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



Denali Therapeutics Inc.

US Patent


Assay Description
Assay was performed in polystyrene low volume 384-well black plate, at Room Temperature (RT) in a final volume of 10.1 μl/well using 10 nM of GS...


US Patent US9815850 (2017)


BindingDB Entry DOI: 10.7270/Q2W0987J
More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM356486
PNG
(US10604535, Example 221 | US9815850, Compound 221 ...)
Show SMILES C[C@H]1Oc2cccnc2N(C)C(=O)[C@H]1NC(=O)c1nnc(o1)C(F)(F)c1ccccc1 |r|
Show InChI InChI=1S/C20H17F2N5O4/c1-11-14(18(29)27(2)15-13(30-11)9-6-10-23-15)24-16(28)17-25-26-19(31-17)20(21,22)12-7-4-3-5-8-12/h3-11,14H,1-2H3,(H,24,28)/t11-,14+/m1/s1
PDB

UniProtKB/SwissProt

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)


BindingDB Entry DOI: 10.7270/Q2VD72G8
More data for this
Ligand-Target Pair