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BDBM89414 MLS001111074::N-[1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-3-(2-ketopyrrolidino)propionamide::N-[1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-3-(2-oxidanylidenepyrrolidin-1-yl)propanamide::N-[1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-3-(2-oxo-1-pyrrolidinyl)propanamide::N-[1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-3-(2-oxopyrrolidin-1-yl)propanamide::SMR000654544::cid_24817543

SMILES: CC(C)(C)c1ccc(cc1)-n1ncc2C(CCCc12)NC(=O)CCN1CCCC1=O

InChI Key: InChIKey=VINMCECDGAJPIF-UHFFFAOYSA-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 = 89414   
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
Protein Wnt-3a


(Mus musculus)
BDBM89414
PNG
(MLS001111074 | N-[1-(4-tert-butylphenyl)-4,5,6,7-t...)
Show SMILES CC(C)(C)c1ccc(cc1)-n1ncc2C(CCCc12)NC(=O)CCN1CCCC1=O
Show InChI InChI=1S/C24H32N4O2/c1-24(2,3)17-9-11-18(12-10-17)28-21-7-4-6-20(19(21)16-25-28)26-22(29)13-15-27-14-5-8-23(27)30/h9-12,16,20H,4-8,13-15H2,1-3H3,(H,26,29)
PDB

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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 973n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q25B012X
More data for this
Ligand-Target Pair
Zinc finger protein GLI1


(Mus musculus)
BDBM89414
PNG
(MLS001111074 | N-[1-(4-tert-butylphenyl)-4,5,6,7-t...)
Show SMILES CC(C)(C)c1ccc(cc1)-n1ncc2C(CCCc12)NC(=O)CCN1CCCC1=O
Show InChI InChI=1S/C24H32N4O2/c1-24(2,3)17-9-11-18(12-10-17)28-21-7-4-6-20(19(21)16-25-28)26-22(29)13-15-27-14-5-8-23(27)30/h9-12,16,20H,4-8,13-15H2,1-3H3,(H,26,29)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.66E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2862F26
More data for this
Ligand-Target Pair