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SMILES: COc1ccc(NC(=O)Cn2nnc(c2COc2ccc3ccccc3c2)-c2ccccc2)cn1

InChI Key: InChIKey=QVPJJIZGBNPDJO-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 = 113958   
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
Disintegrin and metalloproteinase domain-containing protein 10


(Homo sapiens (Human))
BDBM113958
PNG
(MLS003121812 | N-(6-methoxy-3-pyridinyl)-2-[5-(2-n...)
Show SMILES COc1ccc(NC(=O)Cn2nnc(c2COc2ccc3ccccc3c2)-c2ccccc2)cn1
Show InChI InChI=1S/C27H23N5O3/c1-34-26-14-12-22(16-28-26)29-25(33)17-32-24(27(30-31-32)20-8-3-2-4-9-20)18-35-23-13-11-19-7-5-6-10-21(19)15-23/h2-16H,17-18H2,1H3,(H,29,33)
PDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 7.72E+3n/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/Q2930RT9
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17


(Homo sapiens (Human))
BDBM113958
PNG
(MLS003121812 | N-(6-methoxy-3-pyridinyl)-2-[5-(2-n...)
Show SMILES COc1ccc(NC(=O)Cn2nnc(c2COc2ccc3ccccc3c2)-c2ccccc2)cn1
Show InChI InChI=1S/C27H23N5O3/c1-34-26-14-12-22(16-28-26)29-25(33)17-32-24(27(30-31-32)20-8-3-2-4-9-20)18-35-23-13-11-19-7-5-6-10-21(19)15-23/h2-16H,17-18H2,1H3,(H,29,33)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
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/Q2DV1HJQ
More data for this
Ligand-Target Pair