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SMILES: CC(C)c1ccccc1-c1ncc2[nH]c(=O)n(Cc3ccc(cc3)-n3ccc(n3)N3CCN(C)CC3)c2n1

InChI Key: InChIKey=KPJCEJMLLJZXJY-UHFFFAOYSA-N

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 2 hits for monomerid = 324967   
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
Ubiquitin carboxyl-terminal hydrolase 1


(Homo sapiens (Human))
BDBM324967
PNG
(2-(2-isopropylphenyl)-9-(4- | US10189841, Compound...)
Show SMILES CC(C)c1ccccc1-c1ncc2[nH]c(=O)n(Cc3ccc(cc3)-n3ccc(n3)N3CCN(C)CC3)c2n1
Show InChI InChI=1S/C29H32N8O/c1-20(2)23-6-4-5-7-24(23)27-30-18-25-28(32-27)36(29(38)31-25)19-21-8-10-22(11-9-21)37-13-12-26(33-37)35-16-14-34(3)15-17-35/h4-13,18,20H,14-17,19H2,1-3H3,(H,31,38)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a



FORMA Therapeutics, Inc.

US Patent


Assay Description
The HTS assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corning...


US Patent US10399980 (2019)


BindingDB Entry DOI: 10.7270/Q23J3GCX
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 1


(Homo sapiens (Human))
BDBM324967
PNG
(2-(2-isopropylphenyl)-9-(4- | US10189841, Compound...)
Show SMILES CC(C)c1ccccc1-c1ncc2[nH]c(=O)n(Cc3ccc(cc3)-n3ccc(n3)N3CCN(C)CC3)c2n1
Show InChI InChI=1S/C29H32N8O/c1-20(2)23-6-4-5-7-24(23)27-30-18-25-28(32-27)36(29(38)31-25)19-21-8-10-22(11-9-21)37-13-12-26(33-37)35-16-14-34(3)15-17-35/h4-13,18,20H,14-17,19H2,1-3H3,(H,31,38)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a



FORMA Therapeutics, Inc.

US Patent


Assay Description
The HTS assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corning...


US Patent US10189841 (2019)


BindingDB Entry DOI: 10.7270/Q22R3TRR
More data for this
Ligand-Target Pair