Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL2370337

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(N)=O)C(C)C)C(C)C)C(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2370337
Phase Preclinical
Structure Type BOTH
InChI Key PAQMAJCMFRJVSK-IWRNBGLHSA-N
3
Targets
6
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

4271.0
MW (Da)

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C189H306N58O51S2
MW 4271.02

Activity Summary

EC50 6 meas. best 9.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
UMR106-06
CHEMBL613502
 EC50 9.0 8.74 1.0 2
SAOS-2
CHEMBL614894
 EC50 8.62 8.57 2.4 2
OK-1
CHEMBL614209
 EC50 8.23 8.19 5.9 2

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
UMR106-06 EC50 = 1.0 nM 9.0 Compound was evaluated for the accumulation of cyclic AMP in UMR10606 (rat osteo... -
SAOS-2 EC50 = 2.4 nM 8.62 Compound was evaluated for the accumulation of cyclic AMP in SaOS-2 (human osteo... -
SAOS-2 EC50 = 3.0 nM 8.52 Compound was evaluated for the accumulation of cyclic AMP in SaOS-2 (human osteo... -
UMR106-06 EC50 = 3.3 nM 8.48 Compound was evaluated for the accumulation of cyclic AMP in UMR10606 (rat osteo... -
OK-1 EC50 = 5.9 nM 8.23 Accumulation of cyclic AMP in OK-1 cells. -
OK-1 EC50 = 7.0 nM 8.15 Accumulation of cyclic AMP in OK-1 cells. -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(96)00188-6 OK-1 6
- 10.1016/0960-894X(96)00188-6 UMR106-06 4
- 10.1016/0960-894X(96)00188-6 SAOS-2 4

Data from ChEMBL 36 via Core Engine