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SMILES: COCn1cc(cn1)-c1cc(OC)cc(c1)S(=O)(=O)c1cnc(CN)s1

InChI Key: InChIKey=CDKHLQFVQILCQQ-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 = 469122   
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
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469122
PNG
((5-((3-Methoxy-5-(1-(methoxymethyl)-1H-pyrazol-4-y...)
Show SMILES COCn1cc(cn1)-c1cc(OC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C16H18N4O4S2/c1-23-10-20-9-12(7-19-20)11-3-13(24-2)5-14(4-11)26(21,22)16-8-18-15(6-17)25-16/h3-5,7-9H,6,10,17H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 72n/an/an/an/an/an/a



The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 1 hour at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469122
PNG
((5-((3-Methoxy-5-(1-(methoxymethyl)-1H-pyrazol-4-y...)
Show SMILES COCn1cc(cn1)-c1cc(OC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C16H18N4O4S2/c1-23-10-20-9-12(7-19-20)11-3-13(24-2)5-14(4-11)26(21,22)16-8-18-15(6-17)25-16/h3-5,7-9H,6,10,17H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 72n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469122
PNG
((5-((3-Methoxy-5-(1-(methoxymethyl)-1H-pyrazol-4-y...)
Show SMILES COCn1cc(cn1)-c1cc(OC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C16H18N4O4S2/c1-23-10-20-9-12(7-19-20)11-3-13(24-2)5-14(4-11)26(21,22)16-8-18-15(6-17)25-16/h3-5,7-9H,6,10,17H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 72n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 1 hr at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair