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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'High affinity nerve growth factor receptor' and Ligand = 'BDBM410193'   
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
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM410193
PNG
(US10370379, Compound 10 | US11059827, Compound 10)
Show SMILES F[C@H]1C[C@@H](N(C1)c1ccn2ncc(C#N)c2n1)c1cc(F)cnc1Cl |r|
Show InChI InChI=1S/C16H11ClF2N6/c17-15-12(3-10(18)7-21-15)13-4-11(19)8-24(13)14-1-2-25-16(23-14)9(5-20)6-22-25/h1-3,6-7,11,13H,4,8H2/t11-,13+/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



BLUEPRINT MEDICINES CORPORATION

US Patent


Assay Description
In each well of a 384-well plate, 1 nM-1.5 nM of wild type NTRK1 enzyme (BPS Bioscience; 40280) was incubated in a total of 12.5 μL of buffer (1...


US Patent US10370379 (2019)


BindingDB Entry DOI: 10.7270/Q2TM7DG5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM410193
PNG
(US10370379, Compound 10 | US11059827, Compound 10)
Show SMILES F[C@H]1C[C@@H](N(C1)c1ccn2ncc(C#N)c2n1)c1cc(F)cnc1Cl |r|
Show InChI InChI=1S/C16H11ClF2N6/c17-15-12(3-10(18)7-21-15)13-4-11(19)8-24(13)14-1-2-25-16(23-14)9(5-20)6-22-25/h1-3,6-7,11,13H,4,8H2/t11-,13+/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a


TBA

Assay Description
In each well of a 384-well plate, 1 nM-1.5 nM of wild type NTRK1 enzyme (BPS Bioscience; 40280) was incubated in a total of 12.5 μL of buffer (1...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2TB1B1G
More data for this
Ligand-Target Pair