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SMILES: Cc1nc2cc(ccc2s1)-c1ccc2NC(=O)C3(CCN(C3)C#N)Cc2c1

InChI Key: InChIKey=INHRDLUVKVXEFT-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 3 hits for monomerid = 443350   
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
OTU domain-containing protein 7B


(Human)
BDBM443350
PNG
(6'-(2-Methylbenzo[d]thiazol-5-yl)-2'- oxo-1',4'-di...)
Show SMILES Cc1nc2cc(ccc2s1)-c1ccc2NC(=O)C3(CCN(C3)C#N)Cc2c1
Show InChI InChI=1S/C21H18N4OS/c1-13-23-18-9-15(3-5-19(18)27-13)14-2-4-17-16(8-14)10-21(20(26)24-17)6-7-25(11-21)12-22/h2-5,8-9H,6-7,10-11H2,1H3,(H,24,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



MISSION THERAPEUTICS LIMITED

US Patent


Assay Description
Dilution plates were prepared at 21 times the final concentration (2100 μM for a final concentration of 100 μM) in 50% DMSO in a 96-well po...


US Patent US10654853 (2020)


BindingDB Entry DOI: 10.7270/Q21V5J02
More data for this
Ligand-Target Pair
OTU domain-containing protein 7B


(Human)
BDBM443350
PNG
(6'-(2-Methylbenzo[d]thiazol-5-yl)-2'- oxo-1',4'-di...)
Show SMILES Cc1nc2cc(ccc2s1)-c1ccc2NC(=O)C3(CCN(C3)C#N)Cc2c1
Show InChI InChI=1S/C21H18N4OS/c1-13-23-18-9-15(3-5-19(18)27-13)14-2-4-17-16(8-14)10-21(20(26)24-17)6-7-25(11-21)12-22/h2-5,8-9H,6-7,10-11H2,1H3,(H,24,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a


TBA

Assay Description
Dilution plates were prepared at 21 times the final concentration (2100 μM for a final concentration of 100 μM) in 50% DMSO in a 96-well po...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28P63QX
More data for this
Ligand-Target Pair
OTU domain-containing protein 7B


(Human)
BDBM443350
PNG
(6'-(2-Methylbenzo[d]thiazol-5-yl)-2'- oxo-1',4'-di...)
Show SMILES Cc1nc2cc(ccc2s1)-c1ccc2NC(=O)C3(CCN(C3)C#N)Cc2c1
Show InChI InChI=1S/C21H18N4OS/c1-13-23-18-9-15(3-5-19(18)27-13)14-2-4-17-16(8-14)10-21(20(26)24-17)6-7-25(11-21)12-22/h2-5,8-9H,6-7,10-11H2,1H3,(H,24,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a


TBA

Assay Description
Dilution plates were prepared at 21 times the final concentration (2100 μM for a final concentration of 100 μM) in 50% DMSO in a 96-well po...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28P63QX
More data for this
Ligand-Target Pair