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BDBM50311352 2-(1-(3-ethoxy-4-methoxybenzyl)piperidin-4-ylamino)-N,N-dimethylbenzo[d]oxazole-5-sulfonamide::CHEMBL1078528

SMILES: CCOc1cc(CN2CCC(CC2)Nc2nc3cc(ccc3o2)S(=O)(=O)N(C)C)ccc1OC

InChI Key: InChIKey=RMRBRTBXJMVAPE-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50311352   
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))
BDBM50311352
PNG
(2-(1-(3-ethoxy-4-methoxybenzyl)piperidin-4-ylamino...)
Show SMILES CCOc1cc(CN2CCC(CC2)Nc2nc3cc(ccc3o2)S(=O)(=O)N(C)C)ccc1OC
Show InChI InChI=1S/C24H32N4O5S/c1-5-32-23-14-17(6-8-22(23)31-4)16-28-12-10-18(11-13-28)25-24-26-20-15-19(7-9-21(20)33-24)34(29,30)27(2)3/h6-9,14-15,18H,5,10-13,16H2,1-4H3,(H,25,26)
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
226n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Displacement of SST14 from human recombinant SST5 receptor expressed in CHO cells by radioligand binding assay


Bioorg Med Chem Lett 19: 6106-13 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.024
BindingDB Entry DOI: 10.7270/Q2PC32H9
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50311352
PNG
(2-(1-(3-ethoxy-4-methoxybenzyl)piperidin-4-ylamino...)
Show SMILES CCOc1cc(CN2CCC(CC2)Nc2nc3cc(ccc3o2)S(=O)(=O)N(C)C)ccc1OC
Show InChI InChI=1S/C24H32N4O5S/c1-5-32-23-14-17(6-8-22(23)31-4)16-28-12-10-18(11-13-28)25-24-26-20-15-19(7-9-21(20)33-24)34(29,30)27(2)3/h6-9,14-15,18H,5,10-13,16H2,1-4H3,(H,25,26)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Displacement of SST14 from human recombinant SST2 receptor


Bioorg Med Chem Lett 19: 6106-13 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.024
BindingDB Entry DOI: 10.7270/Q2PC32H9
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50311352
PNG
(2-(1-(3-ethoxy-4-methoxybenzyl)piperidin-4-ylamino...)
Show SMILES CCOc1cc(CN2CCC(CC2)Nc2nc3cc(ccc3o2)S(=O)(=O)N(C)C)ccc1OC
Show InChI InChI=1S/C24H32N4O5S/c1-5-32-23-14-17(6-8-22(23)31-4)16-28-12-10-18(11-13-28)25-24-26-20-15-19(7-9-21(20)33-24)34(29,30)27(2)3/h6-9,14-15,18H,5,10-13,16H2,1-4H3,(H,25,26)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Displacement of SST14 from human recombinant SST3 receptor


Bioorg Med Chem Lett 19: 6106-13 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.024
BindingDB Entry DOI: 10.7270/Q2PC32H9
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50311352
PNG
(2-(1-(3-ethoxy-4-methoxybenzyl)piperidin-4-ylamino...)
Show SMILES CCOc1cc(CN2CCC(CC2)Nc2nc3cc(ccc3o2)S(=O)(=O)N(C)C)ccc1OC
Show InChI InChI=1S/C24H32N4O5S/c1-5-32-23-14-17(6-8-22(23)31-4)16-28-12-10-18(11-13-28)25-24-26-20-15-19(7-9-21(20)33-24)34(29,30)27(2)3/h6-9,14-15,18H,5,10-13,16H2,1-4H3,(H,25,26)
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Displacement of SST14 from human recombinant SST4 receptor


Bioorg Med Chem Lett 19: 6106-13 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.024
BindingDB Entry DOI: 10.7270/Q2PC32H9
More data for this
Ligand-Target Pair