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Compound Detail

CHEMBL405151

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CC[C@@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)O

Basic Information

ChEMBL ID CHEMBL405151
Phase Preclinical
Structure Type BOTH
InChI Key NOPXCIKOHHFMKH-DEXSEQFCSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

1198.4
MW (Da)

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C55H91N17O13
MW 1198.44

Activity Summary

Ki 1 meas. best 10.89

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Neurotensin receptor type 1
CHEMBL3570
Ki 10.89 10.89 0.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Neurotensin receptor type 1 Ki = 0.013 nM 10.89 Inhibition of specific binding of [125I]-Tyr3-NT(1-13) to NT receptors in neonat... -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80698-8 Neurotensin receptor type 1 1

Data from ChEMBL 36 via Core Engine