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BDBM70244 6-Amino-4-[3-ethoxy-4-(2-morpholin-4-yl-ethoxy)-phenyl]-3-methyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile::6-amino-4-[3-ethoxy-4-(2-morpholin-4-ylethoxy)phenyl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile::6-amino-4-[3-ethoxy-4-(2-morpholinoethoxy)phenyl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile::6-amino-4-[3-ethoxy-4-[2-(4-morpholinyl)ethoxy]phenyl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile::6-azanyl-4-[3-ethoxy-4-(2-morpholin-4-ylethoxy)phenyl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile::MLS000033723::SMR000013994::cid_645303

SMILES: CCOc1cc(ccc1OCCN1CCOCC1)C1C(C#N)C(=N)Oc2n[nH]c(C)c12

InChI Key: InChIKey=MRQTXGJATBLEBN-UHFFFAOYSA-N

Data: 2 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 = 70244   
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
DNA recombination protein RecA


(Mycobacterium tuberculosis H37Rv)
BDBM70244
PNG
(6-Amino-4-[3-ethoxy-4-(2-morpholin-4-yl-ethoxy)-ph...)
Show SMILES CCOc1cc(ccc1OCCN1CCOCC1)C1C(C#N)C(=N)Oc2n[nH]c(C)c12
Show InChI InChI=1S/C22H27N5O4/c1-3-29-18-12-15(4-5-17(18)30-11-8-27-6-9-28-10-7-27)20-16(13-23)21(24)31-22-19(20)14(2)25-26-22/h4-5,12,16,20,24H,3,6-11H2,1-2H3,(H,25,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 4.45E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: GFP-RecA intein, protein splicing, refolding, reducing reagent, GFP fluorescence Assay Overview: M. tuberculosis harbors three inteins, whi...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2DR2SX9
More data for this
Ligand-Target Pair
DNA recombination protein RecA


(Mycobacterium tuberculosis H37Rv)
BDBM70244
PNG
(6-Amino-4-[3-ethoxy-4-(2-morpholin-4-yl-ethoxy)-ph...)
Show SMILES CCOc1cc(ccc1OCCN1CCOCC1)C1C(C#N)C(=N)Oc2n[nH]c(C)c12
Show InChI InChI=1S/C22H27N5O4/c1-3-29-18-12-15(4-5-17(18)30-11-8-27-6-9-28-10-7-27)20-16(13-23)21(24)31-22-19(20)14(2)25-26-22/h4-5,12,16,20,24H,3,6-11H2,1-2H3,(H,25,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 6.11E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: GFP, refolding, reducing reagent, GFP fluorescence Assay Overview: M. tuberculosis harbors three inteins, which interrupt the DnaB, RecA, a...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2FN14NR
More data for this
Ligand-Target Pair