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BDBM128222 (4-bromanyl-1-methyl-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone::(4-bromo-1-methyl-3-pyrazolyl)-(2,3-dihydroindol-1-yl)methanone::(4-bromo-1-methyl-pyrazol-3-yl)-indolin-1-yl-methanone::(4-bromo-1-methylpyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone::1-[(4-bromo-1-methyl-1H-pyrazol-3-yl)carbonyl]indoline::MLS000703851::SMR000227233::cid_903405

SMILES: Cn1cc(Br)c(n1)C(=O)N1CCc2ccccc12

InChI Key: InChIKey=WJIZIAAAYGEXMI-UHFFFAOYSA-N

Data: 1 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 2 hits for monomerid = 128222   
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
Transthyretin


(Homo sapiens (Human))
BDBM128222
PNG
((4-bromanyl-1-methyl-pyrazol-3-yl)-(2,3-dihydroind...)
Show SMILES Cn1cc(Br)c(n1)C(=O)N1CCc2ccccc12
Show InChI InChI=1S/C13H12BrN3O/c1-16-8-10(14)12(15-16)13(18)17-7-6-9-4-2-3-5-11(9)17/h2-5,8H,6-7H2,1H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>1.67E+5n/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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2DN43RH
More data for this
Ligand-Target Pair
Transthyretin


(Homo sapiens (Human))
BDBM128222
PNG
((4-bromanyl-1-methyl-pyrazol-3-yl)-(2,3-dihydroind...)
Show SMILES Cn1cc(Br)c(n1)C(=O)N1CCc2ccccc12
Show InChI InChI=1S/C13H12BrN3O/c1-16-8-10(14)12(15-16)13(18)17-7-6-9-4-2-3-5-11(9)17/h2-5,8H,6-7H2,1H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>1.67E+5n/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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2JD4VGV
More data for this
Ligand-Target Pair