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BDBM50096823 (S)-6-Amino-2-[(S)-2-[(1-benzoyl-piperidine-4-carbonyl)-amino]-3-(1H-indol-3-yl)-butyrylamino]-hexanoic acid tert-butyl ester::CHEMBL134280

SMILES: C[C@H](C(NC(=O)C1CCN(CC1)C(=O)c1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C)c1c[nH]c2ccccc12

InChI Key: InChIKey=SSIFKGIALREMAH-REVIUNNWSA-N

Data: 3 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50096823   
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 2


(Homo sapiens (Human))
BDBM50096823
PNG
((S)-6-Amino-2-[(S)-2-[(1-benzoyl-piperidine-4-carb...)
Show SMILES C[C@H](C(NC(=O)C1CCN(CC1)C(=O)c1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C)c1c[nH]c2ccccc12
Show InChI InChI=1S/C35H47N5O5/c1-23(27-22-37-28-15-9-8-14-26(27)28)30(32(42)38-29(16-10-11-19-36)34(44)45-35(2,3)4)39-31(41)24-17-20-40(21-18-24)33(43)25-12-6-5-7-13-25/h5-9,12-15,22-24,29-30,37H,10-11,16-21,36H2,1-4H3,(H,38,42)(H,39,41)/t23-,29-,30?/m0/s1
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
0.5n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Somatostatin receptor type 2 was determined


Bioorg Med Chem Lett 11: 415-7 (2001)


BindingDB Entry DOI: 10.7270/Q2474949
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50096823
PNG
((S)-6-Amino-2-[(S)-2-[(1-benzoyl-piperidine-4-carb...)
Show SMILES C[C@H](C(NC(=O)C1CCN(CC1)C(=O)c1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C)c1c[nH]c2ccccc12
Show InChI InChI=1S/C35H47N5O5/c1-23(27-22-37-28-15-9-8-14-26(27)28)30(32(42)38-29(16-10-11-19-36)34(44)45-35(2,3)4)39-31(41)24-17-20-40(21-18-24)33(43)25-12-6-5-7-13-25/h5-9,12-15,22-24,29-30,37H,10-11,16-21,36H2,1-4H3,(H,38,42)(H,39,41)/t23-,29-,30?/m0/s1
Reactome pathway
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UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
416n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity of the compound to hsst5 was determined


Bioorg Med Chem Lett 11: 415-7 (2001)


BindingDB Entry DOI: 10.7270/Q2474949
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50096823
PNG
((S)-6-Amino-2-[(S)-2-[(1-benzoyl-piperidine-4-carb...)
Show SMILES C[C@H](C(NC(=O)C1CCN(CC1)C(=O)c1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C)c1c[nH]c2ccccc12
Show InChI InChI=1S/C35H47N5O5/c1-23(27-22-37-28-15-9-8-14-26(27)28)30(32(42)38-29(16-10-11-19-36)34(44)45-35(2,3)4)39-31(41)24-17-20-40(21-18-24)33(43)25-12-6-5-7-13-25/h5-9,12-15,22-24,29-30,37H,10-11,16-21,36H2,1-4H3,(H,38,42)(H,39,41)/t23-,29-,30?/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
2.66E+3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity of the compound to hsst3 was determined


Bioorg Med Chem Lett 11: 415-7 (2001)


BindingDB Entry DOI: 10.7270/Q2474949
More data for this
Ligand-Target Pair