Found 3 hits Enz. Inhib. hit(s) with Target = 'Somatostatin receptor type 2' and Ligand = 'BDBM50075272' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50075272
((2R,3S)-N-(5-Amino-[1,3]dioxan-2-ylmethyl)-2-[3-(3...)Show SMILES C[C@H]([C@@H](N1CCN(CCC(c2ccccc2)c2ccccc2)C1=O)C(=O)NC[C@H]1OC[C@H](N)CO1)c1c[nH]c2ccccc12 |wU:2.2,28.30,wD:31.34,1.0,(-.69,3.24,;-.68,1.7,;.66,.93,;1.98,1.7,;1.97,3.24,;4.64,3.26,;4.65,1.72,;6,.97,;7.31,1.74,;8.66,.98,;9.99,1.77,;11.32,1,;12.65,1.77,;12.65,3.33,;11.29,4.08,;9.97,3.31,;8.66,-.56,;7.33,-1.33,;7.35,-2.87,;8.69,-3.62,;10.02,-2.83,;10.01,-1.31,;3.32,.95,;3.34,-.59,;.66,-.61,;2.2,-.61,;-.12,-1.94,;.64,-3.27,;-.14,-4.6,;.63,-5.93,;-.16,-7.26,;-1.7,-7.26,;-2.49,-8.57,;-2.45,-5.91,;-1.67,-4.58,;-2.01,.91,;-2,-.61,;-3.33,-1.41,;-4.66,-.64,;-6,-1.41,;-7.33,-.64,;-7.33,.91,;-6,1.68,;-4.66,.91,)| Show InChI InChI=1S/C35H41N5O4/c1-24(30-20-37-31-15-9-8-14-29(30)31)33(34(41)38-21-32-43-22-27(36)23-44-32)40-19-18-39(35(40)42)17-16-28(25-10-4-2-5-11-25)26-12-6-3-7-13-26/h2-15,20,24,27-28,32-33,37H,16-19,21-23,36H2,1H3,(H,38,41)/t24-,27-,32-,33+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 8.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity was evaluated against human Somatostatin receptor type 2 (hSSTR-2) |
Bioorg Med Chem Lett 9: 491-6 (1999)
BindingDB Entry DOI: 10.7270/Q2FB5235 |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50075272
((2R,3S)-N-(5-Amino-[1,3]dioxan-2-ylmethyl)-2-[3-(3...)Show SMILES C[C@H]([C@@H](N1CCN(CCC(c2ccccc2)c2ccccc2)C1=O)C(=O)NC[C@H]1OC[C@H](N)CO1)c1c[nH]c2ccccc12 |wU:2.2,28.30,wD:31.34,1.0,(-.69,3.24,;-.68,1.7,;.66,.93,;1.98,1.7,;1.97,3.24,;4.64,3.26,;4.65,1.72,;6,.97,;7.31,1.74,;8.66,.98,;9.99,1.77,;11.32,1,;12.65,1.77,;12.65,3.33,;11.29,4.08,;9.97,3.31,;8.66,-.56,;7.33,-1.33,;7.35,-2.87,;8.69,-3.62,;10.02,-2.83,;10.01,-1.31,;3.32,.95,;3.34,-.59,;.66,-.61,;2.2,-.61,;-.12,-1.94,;.64,-3.27,;-.14,-4.6,;.63,-5.93,;-.16,-7.26,;-1.7,-7.26,;-2.49,-8.57,;-2.45,-5.91,;-1.67,-4.58,;-2.01,.91,;-2,-.61,;-3.33,-1.41,;-4.66,-.64,;-6,-1.41,;-7.33,-.64,;-7.33,.91,;-6,1.68,;-4.66,.91,)| Show InChI InChI=1S/C35H41N5O4/c1-24(30-20-37-31-15-9-8-14-29(30)31)33(34(41)38-21-32-43-22-27(36)23-44-32)40-19-18-39(35(40)42)17-16-28(25-10-4-2-5-11-25)26-12-6-3-7-13-26/h2-15,20,24,27-28,32-33,37H,16-19,21-23,36H2,1H3,(H,38,41)/t24-,27-,32-,33+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| | 8.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50075272
((2R,3S)-N-(5-Amino-[1,3]dioxan-2-ylmethyl)-2-[3-(3...)Show SMILES C[C@H]([C@@H](N1CCN(CCC(c2ccccc2)c2ccccc2)C1=O)C(=O)NC[C@H]1OC[C@H](N)CO1)c1c[nH]c2ccccc12 |wU:2.2,28.30,wD:31.34,1.0,(-.69,3.24,;-.68,1.7,;.66,.93,;1.98,1.7,;1.97,3.24,;4.64,3.26,;4.65,1.72,;6,.97,;7.31,1.74,;8.66,.98,;9.99,1.77,;11.32,1,;12.65,1.77,;12.65,3.33,;11.29,4.08,;9.97,3.31,;8.66,-.56,;7.33,-1.33,;7.35,-2.87,;8.69,-3.62,;10.02,-2.83,;10.01,-1.31,;3.32,.95,;3.34,-.59,;.66,-.61,;2.2,-.61,;-.12,-1.94,;.64,-3.27,;-.14,-4.6,;.63,-5.93,;-.16,-7.26,;-1.7,-7.26,;-2.49,-8.57,;-2.45,-5.91,;-1.67,-4.58,;-2.01,.91,;-2,-.61,;-3.33,-1.41,;-4.66,-.64,;-6,-1.41,;-7.33,-.64,;-7.33,.91,;-6,1.68,;-4.66,.91,)| Show InChI InChI=1S/C35H41N5O4/c1-24(30-20-37-31-15-9-8-14-29(30)31)33(34(41)38-21-32-43-22-27(36)23-44-32)40-19-18-39(35(40)42)17-16-28(25-10-4-2-5-11-25)26-12-6-3-7-13-26/h2-15,20,24,27-28,32-33,37H,16-19,21-23,36H2,1H3,(H,38,41)/t24-,27-,32-,33+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 8.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity of the compound was evaluated against human Somatostatin receptor type 2 in experiment 2 |
Bioorg Med Chem Lett 9: 491-6 (1999)
BindingDB Entry DOI: 10.7270/Q2FB5235 |
More data for this
Ligand-Target Pair | |
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