BDBM50064778 (5S,8R,11R,14R,17R,19aR)-11-(4-Amino-butyl)-17-benzyl-5-(4-hydroxy-benzyl)-14-(1-hydroxy-ethyl)-8-(1H-indol-3-ylmethyl)-tetradecahydro-3a,6,9,12,15,18-hexaaza-cyclopentacyclooctadecene-4,7,10,13,16,19-hexaone::CHEMBL406471::L-363,377::L-363377

SMILES CC(O)[C@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CCCCN)NC1=O

InChI Key InChIKey=JVHHRGNQHDEURZ-UHFFFAOYSA-N

Data  5 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50064778   

TargetSomatostatin receptor type 2(Human)
Merck Research Laboratories

Curated by PDSP Ki Database
LigandPNGBDBM50064778((5S,8R,11R,14R,17R,19aR)-11-(4-Amino-butyl)-17-ben...)
Affinity DataKi:  0.490nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2012
Entry Details Article
PubMed
TargetSomatostatin receptor type 5(Human)
Merck Research Laboratories

Curated by PDSP Ki Database
LigandPNGBDBM50064778((5S,8R,11R,14R,17R,19aR)-11-(4-Amino-butyl)-17-ben...)
Affinity DataKi:  2.01E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2012
Entry Details Article
PubMed
TargetSomatostatin receptor type 3(Human)
Merck Research Laboratories

Curated by PDSP Ki Database
LigandPNGBDBM50064778((5S,8R,11R,14R,17R,19aR)-11-(4-Amino-butyl)-17-ben...)
Affinity DataKi:  3.07E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2012
Entry Details Article
PubMed
TargetSomatostatin receptor type 1(Human)
Merck Research Laboratories

Curated by PDSP Ki Database
LigandPNGBDBM50064778((5S,8R,11R,14R,17R,19aR)-11-(4-Amino-butyl)-17-ben...)
Affinity DataKi:  5.66E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2012
Entry Details Article
PubMed
TargetSomatostatin receptor type 4(Human)
Merck Research Laboratories

Curated by PDSP Ki Database
LigandPNGBDBM50064778((5S,8R,11R,14R,17R,19aR)-11-(4-Amino-butyl)-17-ben...)
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2012
Entry Details Article
PubMed