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BDBM50314582 (4-(3-(1,2-dimethyl-7-(3-nitrophenyl)-1H-pyrrolo[3,2-d]pyridazin-4-ylamino)propyl)piperazin-1-yl)(pyridazin-4-yl)methanone::CHEMBL1090405

SMILES: Cc1cc2c(NCCCN3CCN(CC3)C(=O)c3ccnnc3)nnc(-c3cccc(c3)[N+]([O-])=O)c2n1C

InChI Key: InChIKey=NZAKJLXLGGYYCX-UHFFFAOYSA-N

Data: 2 KI

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 = 50314582   
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
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50314582
PNG
((4-(3-(1,2-dimethyl-7-(3-nitrophenyl)-1H-pyrrolo[3...)
Show SMILES Cc1cc2c(NCCCN3CCN(CC3)C(=O)c3ccnnc3)nnc(-c3cccc(c3)[N+]([O-])=O)c2n1C
Show InChI InChI=1S/C26H29N9O3/c1-18-15-22-24(32(18)2)23(19-5-3-6-21(16-19)35(37)38)30-31-25(22)27-8-4-10-33-11-13-34(14-12-33)26(36)20-7-9-28-29-17-20/h3,5-7,9,15-17H,4,8,10-14H2,1-2H3,(H,27,31)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.44E+3n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [methyl-3H]rolipram from PDE4B3 expressed in CHO cells after 1 hr by scintillation counting


Bioorg Med Chem Lett 20: 2163-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.044
BindingDB Entry DOI: 10.7270/Q2NK3F54
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50314582
PNG
((4-(3-(1,2-dimethyl-7-(3-nitrophenyl)-1H-pyrrolo[3...)
Show SMILES Cc1cc2c(NCCCN3CCN(CC3)C(=O)c3ccnnc3)nnc(-c3cccc(c3)[N+]([O-])=O)c2n1C
Show InChI InChI=1S/C26H29N9O3/c1-18-15-22-24(32(18)2)23(19-5-3-6-21(16-19)35(37)38)30-31-25(22)27-8-4-10-33-11-13-34(14-12-33)26(36)20-7-9-28-29-17-20/h3,5-7,9,15-17H,4,8,10-14H2,1-2H3,(H,27,31)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.12E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [methyl-3H]rolipram from PDE4D4 expressed in CHO cells after 1 hr by scintillation counting


Bioorg Med Chem Lett 20: 2163-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.044
BindingDB Entry DOI: 10.7270/Q2NK3F54
More data for this
Ligand-Target Pair