BindingDB logo
myBDB logout

BDBM50099179 CHEMBL368334::N-[(R)-2-(1H-Indol-3-yl)-1-(4-phenyl-1H-imidazol-2-yl)-ethyl]-4-methoxy-benzamidine

SMILES: COc1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1

InChI Key: InChIKey=FPROEWGCWWRFDP-XMMPIXPASA-N

Data: 5 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 5 hits for monomerid = 50099179   
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))
BDBM50099179
PNG
(CHEMBL368334 | N-[(R)-2-(1H-Indol-3-yl)-1-(4-pheny...)
Show SMILES COc1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1 |w:8.9|
Show InChI InChI=1S/C27H25N5O/c1-33-21-13-11-19(12-14-21)26(28)31-24(15-20-16-29-23-10-6-5-9-22(20)23)27-30-17-25(32-27)18-7-3-2-4-8-18/h2-14,16-17,24,29H,15H2,1H3,(H2,28,31)(H,30,32)/t24-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
36n/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)


BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM50099179
PNG
(CHEMBL368334 | N-[(R)-2-(1H-Indol-3-yl)-1-(4-pheny...)
Show SMILES COc1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1 |w:8.9|
Show InChI InChI=1S/C27H25N5O/c1-33-21-13-11-19(12-14-21)26(28)31-24(15-20-16-29-23-10-6-5-9-22(20)23)27-30-17-25(32-27)18-7-3-2-4-8-18/h2-14,16-17,24,29H,15H2,1H3,(H2,28,31)(H,30,32)/t24-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.62E+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)


BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50099179
PNG
(CHEMBL368334 | N-[(R)-2-(1H-Indol-3-yl)-1-(4-pheny...)
Show SMILES COc1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1 |w:8.9|
Show InChI InChI=1S/C27H25N5O/c1-33-21-13-11-19(12-14-21)26(28)31-24(15-20-16-29-23-10-6-5-9-22(20)23)27-30-17-25(32-27)18-7-3-2-4-8-18/h2-14,16-17,24,29H,15H2,1H3,(H2,28,31)(H,30,32)/t24-/m1/s1
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.31E+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)


BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM50099179
PNG
(CHEMBL368334 | N-[(R)-2-(1H-Indol-3-yl)-1-(4-pheny...)
Show SMILES COc1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1 |w:8.9|
Show InChI InChI=1S/C27H25N5O/c1-33-21-13-11-19(12-14-21)26(28)31-24(15-20-16-29-23-10-6-5-9-22(20)23)27-30-17-25(32-27)18-7-3-2-4-8-18/h2-14,16-17,24,29H,15H2,1H3,(H2,28,31)(H,30,32)/t24-/m1/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
5.01E+3n/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)


BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM50099179
PNG
(CHEMBL368334 | N-[(R)-2-(1H-Indol-3-yl)-1-(4-pheny...)
Show SMILES COc1ccc(cc1)C(N)=N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1 |w:8.9|
Show InChI InChI=1S/C27H25N5O/c1-33-21-13-11-19(12-14-21)26(28)31-24(15-20-16-29-23-10-6-5-9-22(20)23)27-30-17-25(32-27)18-7-3-2-4-8-18/h2-14,16-17,24,29H,15H2,1H3,(H2,28,31)(H,30,32)/t24-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
6.18E+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)


BindingDB Entry DOI: 10.7270/Q2D50NHN
More data for this
Ligand-Target Pair