Compound Detail

CHEMBL2372184

CONANTOKIN-R

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CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C(=O)O)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C(=O)O)C(=O)O)NC(=O)[C@H](CC(C(=O)O)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CN)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)O)C(C)C

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL2372184
Name	CONANTOKIN-R
Phase	Preclinical
Structure Type	MOL
InChI Key	HDQKHLOQDCJGIV-HHXUSTKESA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

3100.4

MW (Da)

Drug Information

Molecule Type	Protein
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C127H203N35O49S3
MW	3100.42

Activity Summary

IC50 3 meas. best 6.0

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Glutamate receptor ionotropic, NMDA 2A CHEMBL310	IC50	6.0	6.0	1000.0	1
Glutamate receptor ionotropic, NMDA 2B CHEMBL311	IC50	6.0	6.0	1000.0	1
Glutamate receptor ionotropic, NMDA 2C CHEMBL401	IC50	5.16	5.16	7000.0	1

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Glutamate receptor ionotropic, NMDA 2A	IC50	=	1000.0	nM	6.0	Inhibition of rat NMDA NR2A receptor expressed in xenopus oocytes coexpressing N...	17962189
Glutamate receptor ionotropic, NMDA 2B	IC50	=	1000.0	nM	6.0	Inhibition of rat NMDA NR2B receptor expressed in xenopus oocytes coexpressing N...	17962189
Glutamate receptor ionotropic, NMDA 2C	IC50	=	7000.0	nM	5.16	Inhibition of rat NMDA NR2C receptor expressed in xenopus oocytes coexpressing N...	17962189

Literature References

PubMed	DOI	Target Context	# Activities
17962189	10.1074/jbc.m706611200	Unchecked	2
17962189	10.1074/jbc.m706611200	Glutamate receptor ionotropic, NMDA 2A	1
17962189	10.1074/jbc.m706611200	Glutamate receptor ionotropic, NMDA 2B	1
17962189	10.1074/jbc.m706611200	Glutamate receptor ionotropic, NMDA 2C	1
17962189	10.1074/jbc.m706611200	Glutamate receptor ionotropic, NMDA 2D	1

Data from ChEMBL 36 via Core Engine