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BDBM44653 3-(2,2-dimethylpropanoylamino)-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide::3-[(2,2-dimethyl-1-oxopropyl)amino]-N-(4-methoxyphenyl)-2-benzofurancarboxamide::3-[(2,2-dimethylpropanoyl)amino]-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide::MLS000092987::N-(4-methoxyphenyl)-3-(pivaloylamino)coumarilamide::SMR000028623::cid_3241060

SMILES: COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)C(C)(C)C)cc1

InChI Key: InChIKey=NNZBCPMPXNVQPE-UHFFFAOYSA-N

Data: 2 IC50  1 EC50

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 = 44653   
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
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM44653
PNG
(3-(2,2-dimethylpropanoylamino)-N-(4-methoxyphenyl)...)
Show SMILES COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)C(C)(C)C)cc1
Show InChI InChI=1S/C21H22N2O4/c1-21(2,3)20(25)23-17-15-7-5-6-8-16(15)27-18(17)19(24)22-13-9-11-14(26-4)12-10-13/h5-12H,1-4H3,(H,22,24)(H,23,25)
PDB

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Similars

n/an/an/an/a 3.41E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q25719FH
More data for this
Ligand-Target Pair
ADAM17


(Homo sapiens (Human))
BDBM44653
PNG
(3-(2,2-dimethylpropanoylamino)-N-(4-methoxyphenyl)...)
Show SMILES COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)C(C)(C)C)cc1
Show InChI InChI=1S/C21H22N2O4/c1-21(2,3)20(25)23-17-15-7-5-6-8-16(15)27-18(17)19(24)22-13-9-11-14(26-4)12-10-13/h5-12H,1-4H3,(H,22,24)(H,23,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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PC cid
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UniChem

Similars

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))
BDBM44653
PNG
(3-(2,2-dimethylpropanoylamino)-N-(4-methoxyphenyl)...)
Show SMILES COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)C(C)(C)C)cc1
Show InChI InChI=1S/C21H22N2O4/c1-21(2,3)20(25)23-17-15-7-5-6-8-16(15)27-18(17)19(24)22-13-9-11-14(26-4)12-10-13/h5-12H,1-4H3,(H,22,24)(H,23,25)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

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