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BDBM50468142 CHEMBL4280432

SMILES: Cc1cc(c(CN2CCC3(CN(C(=O)C3)c3ccc(cc3)C(O)=O)CC2)cc1C(F)(F)F)-c1ccc(F)c(F)c1F

InChI Key: InChIKey=HSXIPZDTFGIFKD-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50468142   
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
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50468142
PNG
(CHEMBL4280432)
Show SMILES Cc1cc(c(CN2CCC3(CN(C(=O)C3)c3ccc(cc3)C(O)=O)CC2)cc1C(F)(F)F)-c1ccc(F)c(F)c1F
Show InChI InChI=1S/C30H26F6N2O3/c1-17-12-22(21-6-7-24(31)27(33)26(21)32)19(13-23(17)30(34,35)36)15-37-10-8-29(9-11-37)14-25(39)38(16-29)20-4-2-18(3-5-20)28(40)41/h2-7,12-13H,8-11,14-16H2,1H3,(H,40,41)
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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.90n/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Displacement of [3-125I-Tyr11]-SRIF-14 or [3-125I-Tyr11]-SRIF-28 from human SSR5 expressed in CHOK1 cell membranes


ACS Med Chem Lett 9: 1088-1093 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00306
BindingDB Entry DOI: 10.7270/Q2V127H3
More data for this
Ligand-Target Pair
Somatostatin receptor


(Mus musculus)
BDBM50468142
PNG
(CHEMBL4280432)
Show SMILES Cc1cc(c(CN2CCC3(CN(C(=O)C3)c3ccc(cc3)C(O)=O)CC2)cc1C(F)(F)F)-c1ccc(F)c(F)c1F
Show InChI InChI=1S/C30H26F6N2O3/c1-17-12-22(21-6-7-24(31)27(33)26(21)32)19(13-23(17)30(34,35)36)15-37-10-8-29(9-11-37)14-25(39)38(16-29)20-4-2-18(3-5-20)28(40)41/h2-7,12-13H,8-11,14-16H2,1H3,(H,40,41)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 120n/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Antagonist activity at mouse SSR5 expressed in CHOK1 cells assessed as inhibition of forskolin-induced cAMP accumulation preincubated for 15 mins fol...


ACS Med Chem Lett 9: 1088-1093 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00306
BindingDB Entry DOI: 10.7270/Q2V127H3
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50468142
PNG
(CHEMBL4280432)
Show SMILES Cc1cc(c(CN2CCC3(CN(C(=O)C3)c3ccc(cc3)C(O)=O)CC2)cc1C(F)(F)F)-c1ccc(F)c(F)c1F
Show InChI InChI=1S/C30H26F6N2O3/c1-17-12-22(21-6-7-24(31)27(33)26(21)32)19(13-23(17)30(34,35)36)15-37-10-8-29(9-11-37)14-25(39)38(16-29)20-4-2-18(3-5-20)28(40)41/h2-7,12-13H,8-11,14-16H2,1H3,(H,40,41)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Antagonist activity at human SSR5 expressed in CHOK1 cells assessed as inhibition of forskolin-induced cAMP accumulation preincubated for 15 mins fol...


ACS Med Chem Lett 9: 1088-1093 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00306
BindingDB Entry DOI: 10.7270/Q2V127H3
More data for this
Ligand-Target Pair