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BDBM42661 (6Z)-6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-ethoxy-1-cyclohexa-2,4-dienone::(6Z)-6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-ethoxy-cyclohexa-2,4-dien-1-one::(6Z)-6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-ethoxycyclohexa-2,4-dien-1-one::(6Z)-6-(2-azanyl-5-phenyl-1H-pyrimidin-6-ylidene)-3-ethoxy-cyclohexa-2,4-dien-1-one::MLS000042426::SMR000047772::cid_5390022

SMILES: CCOc1ccc(c(O)c1)-c1nc(N)ncc1-c1ccccc1

InChI Key: InChIKey=FHRLCCBVWMQEFD-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 = 42661   
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
integrin alpha-L


(Mus musculus)
BDBM42661
PNG
((6Z)-6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3...)
Show SMILES CCOc1ccc(c(O)c1)-c1nc(N)ncc1-c1ccccc1
Show InChI InChI=1S/C18H17N3O2/c1-2-23-13-8-9-14(16(22)10-13)17-15(11-20-18(19)21-17)12-6-4-3-5-7-12/h3-11,22H,2H2,1H3,(H2,19,20,21)
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 173n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1 X01 MH085707-01 Project Title: HTS for developing T Cell Immune Modulators Assay Provid...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2XW4H88
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM42661
PNG
((6Z)-6-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3...)
Show SMILES CCOc1ccc(c(O)c1)-c1nc(N)ncc1-c1ccccc1
Show InChI InChI=1S/C18H17N3O2/c1-2-23-13-8-9-14(16(22)10-13)17-15(11-20-18(19)21-17)12-6-4-3-5-7-12/h3-11,22H,2H2,1H3,(H2,19,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.27E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2KK996K
More data for this
Ligand-Target Pair