new BindingDB logo
myBDB logout

BDBM50295519 CHEMBL554291::N-(3,4-Dimethoxyphenyl)-2-[5-(3-methoxybenzyl)-3-methyl-6-oxo-6H-pyridazin-1-yl]-acetamide

SMILES: COc1cccc(Cc2cc(C)nn(CC(=O)Nc3ccc(OC)c(OC)c3)c2=O)c1

InChI Key: InChIKey=AIJUIYMBFKWGDS-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50295519   
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
fMet-Leu-Phe receptor 1/2


(Homo sapiens)
BDBM50295519
PNG
(CHEMBL554291 | N-(3,4-Dimethoxyphenyl)-2-[5-(3-met...)
Show SMILES COc1cccc(Cc2cc(C)nn(CC(=O)Nc3ccc(OC)c(OC)c3)c2=O)c1
Show InChI InChI=1S/C23H25N3O5/c1-15-10-17(11-16-6-5-7-19(12-16)29-2)23(28)26(25-15)14-22(27)24-18-8-9-20(30-3)21(13-18)31-4/h5-10,12-13H,11,14H2,1-4H3,(H,24,27)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 155n/an/an/an/a



Universita degli Studi di Firenze

Curated by ChEMBL


Assay Description
Agonist activity at FPR1 expressed in human HL60 cells assessed as induction of intracellular calcium flux by FLIPR3 calcium assay


J Med Chem 52: 5044-57 (2010)

More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM50295519
PNG
(CHEMBL554291 | N-(3,4-Dimethoxyphenyl)-2-[5-(3-met...)
Show SMILES COc1cccc(Cc2cc(C)nn(CC(=O)Nc3ccc(OC)c(OC)c3)c2=O)c1
Show InChI InChI=1S/C23H25N3O5/c1-15-10-17(11-16-6-5-7-19(12-16)29-2)23(28)26(25-15)14-22(27)24-18-8-9-20(30-3)21(13-18)31-4/h5-10,12-13H,11,14H2,1-4H3,(H,24,27)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 168n/an/an/an/a



Universita degli Studi di Firenze

Curated by ChEMBL


Assay Description
Agonist activity at FPRL1 expressed in human HL60 cells assessed as induction of intracellular calcium flux by FLIPR3 calcium assay


J Med Chem 52: 5044-57 (2010)

More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM50295519
PNG
(CHEMBL554291 | N-(3,4-Dimethoxyphenyl)-2-[5-(3-met...)
Show SMILES COc1cccc(Cc2cc(C)nn(CC(=O)Nc3ccc(OC)c(OC)c3)c2=O)c1
Show InChI InChI=1S/C23H25N3O5/c1-15-10-17(11-16-6-5-7-19(12-16)29-2)23(28)26(25-15)14-22(27)24-18-8-9-20(30-3)21(13-18)31-4/h5-10,12-13H,11,14H2,1-4H3,(H,24,27)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.20E+3n/an/an/an/a



Universita degli Studi di Firenze

Curated by ChEMBL


Assay Description
Agonist activity at FPRL1 expressed in human HL60 cells assessed as induction of intracellular calcium flux by FLIPR3 calcium assay


J Med Chem 52: 5044-57 (2010)

More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM50295519
PNG
(CHEMBL554291 | N-(3,4-Dimethoxyphenyl)-2-[5-(3-met...)
Show SMILES COc1cccc(Cc2cc(C)nn(CC(=O)Nc3ccc(OC)c(OC)c3)c2=O)c1
Show InChI InChI=1S/C23H25N3O5/c1-15-10-17(11-16-6-5-7-19(12-16)29-2)23(28)26(25-15)14-22(27)24-18-8-9-20(30-3)21(13-18)31-4/h5-10,12-13H,11,14H2,1-4H3,(H,24,27)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 12n/an/an/an/a



Universita degli Studi di Firenze

Curated by ChEMBL


Assay Description
Agonist activity at FPRL1 in human neutrophiles assessed as induction of intracellular calcium flux by FLIPR3 calcium assay


J Med Chem 52: 5044-57 (2010)

More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens)
BDBM50295519
PNG
(CHEMBL554291 | N-(3,4-Dimethoxyphenyl)-2-[5-(3-met...)
Show SMILES COc1cccc(Cc2cc(C)nn(CC(=O)Nc3ccc(OC)c(OC)c3)c2=O)c1
Show InChI InChI=1S/C23H25N3O5/c1-15-10-17(11-16-6-5-7-19(12-16)29-2)23(28)26(25-15)14-22(27)24-18-8-9-20(30-3)21(13-18)31-4/h5-10,12-13H,11,14H2,1-4H3,(H,24,27)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.60E+3n/an/an/an/a



Universita degli Studi di Firenze

Curated by ChEMBL


Assay Description
Agonist activity at FPR1 in human neutrophiles by chemotaxis assay


J Med Chem 52: 5044-57 (2010)

More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens)
BDBM50295519
PNG
(CHEMBL554291 | N-(3,4-Dimethoxyphenyl)-2-[5-(3-met...)
Show SMILES COc1cccc(Cc2cc(C)nn(CC(=O)Nc3ccc(OC)c(OC)c3)c2=O)c1
Show InChI InChI=1S/C23H25N3O5/c1-15-10-17(11-16-6-5-7-19(12-16)29-2)23(28)26(25-15)14-22(27)24-18-8-9-20(30-3)21(13-18)31-4/h5-10,12-13H,11,14H2,1-4H3,(H,24,27)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 36n/an/an/an/a



Universita degli Studi di Firenze

Curated by ChEMBL


Assay Description
Agonist activity at FPR1 in human neutrophiles assessed as induction of intracellular calcium flux by FLIPR3 calcium assay


J Med Chem 52: 5044-57 (2010)

More data for this
Ligand-Target Pair