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BDBM175960 US9688684, Compound 157: 8-(3-Isopropyl-1-phenyl-1H-pyrazol-4-yl)-7-(1,3,5-trimethyl-1H-pyrazol-4-ylmethyl)-5,6,7,8-tetrahydro-tetrazolo[1,5-a]pyrazine

SMILES: CC(C)c1nn(cc1C1N(Cc2c(C)nn(C)c2C)CCn2nnnc12)-c1ccccc1

InChI Key: InChIKey=SKLKCYDAFGOFBZ-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 175960   
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
Leukocyte elastase


(Homo sapiens (Human))
BDBM175960
PNG
(US9688684, Compound 157: 8-(3-Isopropyl-1-phenyl-1...)
Show SMILES CC(C)c1nn(cc1C1N(Cc2c(C)nn(C)c2C)CCn2nnnc12)-c1ccccc1
Show InChI InChI=1S/C23H29N9/c1-15(2)21-20(14-32(26-21)18-9-7-6-8-10-18)22-23-24-27-28-31(23)12-11-30(22)13-19-16(3)25-29(5)17(19)4/h6-10,14-15,22H,11-13H2,1-5H3
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 2.50E+4n/an/an/an/a6.8n/a



Merck Patent GmbH

US Patent


Assay Description
In this assay, a GST-tagged human RORγ ligand binding domain (GST-hRORγ-LBD) interacts with a synthetic biotinylated TRAP220 cofactor pepti...


US Patent US9688684 (2017)


BindingDB Entry DOI: 10.7270/Q2DB7ZZK
More data for this
Ligand-Target Pair