BDBM50511369 CHEMBL4436580

SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCCNC(=N)NC(=O)NCCCCc1cn(CCCNC(=O)CCCCCN2\C(=C\C=C\C=C\C3=[N+](C)c4ccc5c(cc(cc5c4C3(C)C)S(O)(=O)=O)S([O-])(=O)=O)C(C)(C)c3c2ccc2c(cc(cc32)S(O)(=O)=O)S(O)(=O)=O)nn1)C(C)(C)C)C(O)=O

InChI Key InChIKey=RDKANGIHVPYEGN-UHFFFAOYSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50511369   

TargetNeurotensin receptor type 1(Human)
University of Regensburg

Curated by ChEMBL
LigandPNGBDBM50511369(CHEMBL4436580)
Affinity DataKi:  50nMAssay Description:Displacement of [3H]UR-MK300 from human NTS1R expressed in human HT-29 cells incubated for 2 hrs by scintillation counting methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed
TargetNeurotensin receptor type 1(Human)
University of Regensburg

Curated by ChEMBL
LigandPNGBDBM50511369(CHEMBL4436580)
Affinity DataKi:  50nMAssay Description:Displacement of [3H]UR-MK300 from human NTS1R expressed in human HT-29 cells incubated for 2 hrs by scintillation counting methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed