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BDBM50099169 4-tert-Butyl-N-[(R)-2-(1H-indol-3-yl)-1-(4-phenyl-1H-imidazol-2-yl)-ethyl]-benzamidine::CHEMBL176730

SMILES: CC(C)(C)c1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1

InChI Key: InChIKey=BKTYEOBBEGICIU-AREMUKBSSA-N

Data: 5 KI

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

Found 5 hits for monomerid = 50099169   
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 3


(Homo sapiens (Human))
BDBM50099169
PNG
(4-tert-Butyl-N-[(R)-2-(1H-indol-3-yl)-1-(4-phenyl-...)
Show SMILES CC(C)(C)c1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1S/C30H31N5/c1-30(2,3)23-15-13-21(14-16-23)28(31)34-26(17-22-18-32-25-12-8-7-11-24(22)25)29-33-19-27(35-29)20-9-5-4-6-10-20/h4-16,18-19,26,32H,17H2,1-3H3,(H2,31,34)(H,33,35)/t26-/m1/s1
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Article
PubMed
1.40E+3n/an/an/an/an/an/an/an/a



Institut Henri Beaufour

Curated by ChEMBL


Assay Description
Inhibition of human sst3 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 991-5 (2001)


Article DOI: 10.1016/s0960-894x(01)00107-x
BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50099169
PNG
(4-tert-Butyl-N-[(R)-2-(1H-indol-3-yl)-1-(4-phenyl-...)
Show SMILES CC(C)(C)c1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1S/C30H31N5/c1-30(2,3)23-15-13-21(14-16-23)28(31)34-26(17-22-18-32-25-12-8-7-11-24(22)25)29-33-19-27(35-29)20-9-5-4-6-10-20/h4-16,18-19,26,32H,17H2,1-3H3,(H2,31,34)(H,33,35)/t26-/m1/s1
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Article
PubMed
1.87E+3n/an/an/an/an/an/an/an/a



Institut Henri Beaufour

Curated by ChEMBL


Assay Description
Inhibition of human sst5 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 991-5 (2001)


Article DOI: 10.1016/s0960-894x(01)00107-x
BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50099169
PNG
(4-tert-Butyl-N-[(R)-2-(1H-indol-3-yl)-1-(4-phenyl-...)
Show SMILES CC(C)(C)c1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1S/C30H31N5/c1-30(2,3)23-15-13-21(14-16-23)28(31)34-26(17-22-18-32-25-12-8-7-11-24(22)25)29-33-19-27(35-29)20-9-5-4-6-10-20/h4-16,18-19,26,32H,17H2,1-3H3,(H2,31,34)(H,33,35)/t26-/m1/s1
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Article
PubMed
1.88E+3n/an/an/an/an/an/an/an/a



Institut Henri Beaufour

Curated by ChEMBL


Assay Description
Inhibition of human sst1 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 991-5 (2001)


Article DOI: 10.1016/s0960-894x(01)00107-x
BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50099169
PNG
(4-tert-Butyl-N-[(R)-2-(1H-indol-3-yl)-1-(4-phenyl-...)
Show SMILES CC(C)(C)c1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1S/C30H31N5/c1-30(2,3)23-15-13-21(14-16-23)28(31)34-26(17-22-18-32-25-12-8-7-11-24(22)25)29-33-19-27(35-29)20-9-5-4-6-10-20/h4-16,18-19,26,32H,17H2,1-3H3,(H2,31,34)(H,33,35)/t26-/m1/s1
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PubMed
5.92E+3n/an/an/an/an/an/an/an/a



Institut Henri Beaufour

Curated by ChEMBL


Assay Description
Inhibition of human sst2 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 991-5 (2001)


Article DOI: 10.1016/s0960-894x(01)00107-x
BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50099169
PNG
(4-tert-Butyl-N-[(R)-2-(1H-indol-3-yl)-1-(4-phenyl-...)
Show SMILES CC(C)(C)c1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1S/C30H31N5/c1-30(2,3)23-15-13-21(14-16-23)28(31)34-26(17-22-18-32-25-12-8-7-11-24(22)25)29-33-19-27(35-29)20-9-5-4-6-10-20/h4-16,18-19,26,32H,17H2,1-3H3,(H2,31,34)(H,33,35)/t26-/m1/s1
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Institut Henri Beaufour

Curated by ChEMBL


Assay Description
Inhibition of human sst4 receptor expressed in CHO cells


Bioorg Med Chem Lett 11: 991-5 (2001)


Article DOI: 10.1016/s0960-894x(01)00107-x
BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair