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SMILES: CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12

InChI Key: InChIKey=VITCTASELARNMH-VIKVFOODSA-N

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 17 hits for monomerid = 311885   
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 4


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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10.8n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US10675268 (2020)

More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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10.8n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
For the binding experiments 200 μL of membrane homogenate from one of the following protein amounts is used: hSSTR1 (40 μg/well); hSSTR2 (2...


US Patent US10166214 (2019)


BindingDB Entry DOI: 10.7270/Q2D50Q16
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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10.8n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US9789082 (2017)


BindingDB Entry DOI: 10.7270/Q2CN760Q
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>8.58E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US10675268 (2020)

More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>8.58E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US9789082 (2017)


BindingDB Entry DOI: 10.7270/Q2CN760Q
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>8.58E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
For the binding experiments 200 μL of membrane homogenate from one of the following protein amounts is used: hSSTR1 (40 μg/well); hSSTR2 (2...


US Patent US10166214 (2019)


BindingDB Entry DOI: 10.7270/Q2D50Q16
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>8.91E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US10675268 (2020)

More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>8.91E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
For the binding experiments 200 μL of membrane homogenate from one of the following protein amounts is used: hSSTR1 (40 μg/well); hSSTR2 (2...


US Patent US10166214 (2019)


BindingDB Entry DOI: 10.7270/Q2D50Q16
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>8.91E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US9789082 (2017)


BindingDB Entry DOI: 10.7270/Q2CN760Q
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
PDB

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>9.59E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US9789082 (2017)


BindingDB Entry DOI: 10.7270/Q2CN760Q
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
PDB

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>9.59E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US10675268 (2020)

More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
PDB

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>9.59E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
For the binding experiments 200 μL of membrane homogenate from one of the following protein amounts is used: hSSTR1 (40 μg/well); hSSTR2 (2...


US Patent US10166214 (2019)


BindingDB Entry DOI: 10.7270/Q2D50Q16
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>9.85E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
For the binding experiments 200 μL of membrane homogenate from one of the following protein amounts is used: hSSTR1 (40 μg/well); hSSTR2 (2...


US Patent US10166214 (2019)


BindingDB Entry DOI: 10.7270/Q2D50Q16
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>9.85E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US10675268 (2020)

More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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>9.85E+3n/an/an/an/an/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
Receptor binding assays refer to a technique in which labeled receptor ligands are used to detect binding to a receptor. In competition experiments t...


US Patent US9789082 (2017)


BindingDB Entry DOI: 10.7270/Q2CN760Q
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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n/an/an/an/a 0.700n/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
The activation of the SSTR4 receptor (Gi coupled) causes an inhibition of intracellular cAMP after stimulation with Forskolin, which can be quantifia...


US Patent US10166214 (2019)


BindingDB Entry DOI: 10.7270/Q2D50Q16
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM311885
PNG
(US10166214, Example 21 | US10675268, Example 21 | ...)
Show SMILES CC(C)(NC(=O)[C@@H]1[C@H]2CNC[C@@H]12)c1ccnc2ccccc12 |r|
Show InChI InChI=1S/C18H21N3O/c1-18(2,21-17(22)16-12-9-19-10-13(12)16)14-7-8-20-15-6-4-3-5-11(14)15/h3-8,12-13,16,19H,9-10H2,1-2H3,(H,21,22)/t12-,13+,16+
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n/an/an/an/a 0.700n/an/an/an/a



Centrexion Therapeutics Corporation

US Patent


Assay Description
The activation of the SSTR4 receptor (Gi coupled) causes an inhibition of intracellular cAMP after stimulation with Forskolin, which can be quantifia...


US Patent US10675268 (2020)

More data for this
Ligand-Target Pair