BDBM50409026 CHEMBL2112245

SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CSSC[C@@H](NC(=O)[C@H](CO)NC1=O)C(O)=O)[C@@H](C)O

InChI Key InChIKey=AJVHBIHBNFGOHB-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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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 = 50409026   

TargetSubstance-K receptor(Human)
University of Pennsylvania

Curated by ChEMBL
LigandPNGBDBM50409026(CHEMBL2112245)
Affinity DataIC50: 46nMAssay Description:Tested for binding affinity against Tachykinin receptor 2 expressed in CHO cells, using [125]SP as radioligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/24/2012
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
University of Pennsylvania

Curated by ChEMBL
LigandPNGBDBM50409026(CHEMBL2112245)
Affinity DataIC50: 260nMAssay Description:Tested for binding affinity against human wild type NK1 receptor expressed in CHO cells, using [125]SP as radioligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/24/2012
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
University of Pennsylvania

Curated by ChEMBL
LigandPNGBDBM50409026(CHEMBL2112245)
Affinity DataIC50: 250nMAssay Description:Tested for binding affinity against Tachykinin receptor 1 expressed in CHO cells, using [125]SP as radioligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/24/2012
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
University of Pennsylvania

Curated by ChEMBL
LigandPNGBDBM50409026(CHEMBL2112245)
Affinity DataIC50: 9.60E+3nMAssay Description:Tested for binding affinity against H265A mutant NK1 receptor using [125]SP radioligand in COS cells.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/24/2012
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
University of Pennsylvania

Curated by ChEMBL
LigandPNGBDBM50409026(CHEMBL2112245)
Affinity DataIC50: 900nMAssay Description:Tested for binding affinity against H197A mutant NK1 receptor using [125]SP radioligand in COS cells.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/24/2012
Entry Details Article
PubMed