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BDBM50144193 CHEMBL65484::Dicyclopropylmethyl-propyl-[4-(2,4,6-trimethoxy-phenyl)-pyrimidin-2-yl]-amine

SMILES: CCCN(C(C1CC1)C1CC1)c1nccc(n1)-c1c(OC)cc(OC)cc1OC

InChI Key: InChIKey=VVOKUTLMKHSKLC-UHFFFAOYSA-N

Data: 1 KI  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 3 hits for monomerid = 50144193   
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
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50144193
PNG
(CHEMBL65484 | Dicyclopropylmethyl-propyl-[4-(2,4,6...)
Show SMILES CCCN(C(C1CC1)C1CC1)c1nccc(n1)-c1c(OC)cc(OC)cc1OC
Show InChI InChI=1S/C23H31N3O3/c1-5-12-26(22(15-6-7-15)16-8-9-16)23-24-11-10-18(25-23)21-19(28-3)13-17(27-2)14-20(21)29-4/h10-11,13-16,22H,5-9,12H2,1-4H3
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Article
PubMed
15n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human Corticotropin releasing factor receptor 1 by the displacement of [125I]-CRF from CHO cells


Bioorg Med Chem Lett 14: 2083-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.053
BindingDB Entry DOI: 10.7270/Q2JH3KKJ
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50144193
PNG
(CHEMBL65484 | Dicyclopropylmethyl-propyl-[4-(2,4,6...)
Show SMILES CCCN(C(C1CC1)C1CC1)c1nccc(n1)-c1c(OC)cc(OC)cc1OC
Show InChI InChI=1S/C23H31N3O3/c1-5-12-26(22(15-6-7-15)16-8-9-16)23-24-11-10-18(25-23)21-19(28-3)13-17(27-2)14-20(21)29-4/h10-11,13-16,22H,5-9,12H2,1-4H3
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Article
PubMed
n/an/an/an/a 970n/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Effective dose of the compound against CRF stimulated cAMP production in CHO cells expressing human Corticotropin releasing factor receptor 1


Bioorg Med Chem Lett 14: 2083-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.053
BindingDB Entry DOI: 10.7270/Q2JH3KKJ
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM50144193
PNG
(CHEMBL65484 | Dicyclopropylmethyl-propyl-[4-(2,4,6...)
Show SMILES CCCN(C(C1CC1)C1CC1)c1nccc(n1)-c1c(OC)cc(OC)cc1OC
Show InChI InChI=1S/C23H31N3O3/c1-5-12-26(22(15-6-7-15)16-8-9-16)23-24-11-10-18(25-23)21-19(28-3)13-17(27-2)14-20(21)29-4/h10-11,13-16,22H,5-9,12H2,1-4H3
PDB
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Article
PubMed
n/an/an/an/a 990n/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Effective dose of the compound against human Corticotropin releasing factor receptor 1 stimulated ACTH release from primary rat anterior pituitary ce...


Bioorg Med Chem Lett 14: 2083-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.053
BindingDB Entry DOI: 10.7270/Q2JH3KKJ
More data for this
Ligand-Target Pair