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BDBM114067 2-(2-isopropoxyphenyl)-N'-[(E)-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]cinchoninohydrazide::MLS000705003::N'-(4-hydroxy-3-methoxybenzylidene)-2-(2-isopropoxyphenyl)-4-quinolinecarbohydrazide::N'-[(E)-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2-(2-propan-2-yloxyphenyl)quinoline-4-carbohydrazide::N'-[(E)-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2-(2-propan-2-yloxyphenyl)-4-quinolinecarbohydrazide::N'-[(E)-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-(2-propan-2-yloxyphenyl)quinoline-4-carbohydrazide::SMR000231219::cid_6040123

SMILES: COc1cc(C=NNC(=O)c2cc(nc3ccccc23)-c2ccccc2OC(C)C)ccc1O

InChI Key: InChIKey=FHMBUCAZNBSCNG-LQKURTRISA-N

Data: 2 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 2 hits for monomerid = 114067   
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
ADAM17


(Homo sapiens (Human))
BDBM114067
PNG
(2-(2-isopropoxyphenyl)-N'-[(E)-(4-keto-3-methoxy-c...)
Show SMILES COc1cc(C=NNC(=O)c2cc(nc3ccccc23)-c2ccccc2OC(C)C)ccc1O
Show InChI InChI=1S/C27H25N3O4/c1-17(2)34-25-11-7-5-9-20(25)23-15-21(19-8-4-6-10-22(19)29-23)27(32)30-28-16-18-12-13-24(31)26(14-18)33-3/h4-17,31H,1-3H3,(H,30,32)/b28-16+
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.95E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Torrey Pines Institute for Molecul...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q21J98DJ
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10)


(Homo sapiens (Human))
BDBM114067
PNG
(2-(2-isopropoxyphenyl)-N'-[(E)-(4-keto-3-methoxy-c...)
Show SMILES COc1cc(C=NNC(=O)c2cc(nc3ccccc23)-c2ccccc2OC(C)C)ccc1O
Show InChI InChI=1S/C27H25N3O4/c1-17(2)34-25-11-7-5-9-20(25)23-15-21(19-8-4-6-10-22(19)29-23)27(32)30-28-16-18-12-13-24(31)26(14-18)33-3/h4-17,31H,1-3H3,(H,30,32)/b28-16+
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.95E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Torrey Pines Institute for Molecul...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q25B013C
More data for this
Ligand-Target Pair