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CC-90005 , CAS No.C608350, Inhibitor of protein kinase C delta;Inhibitor of protein kinase C theta

Moligand™

PubChem CID: 118162109

Item Number

C608350

Grouped product items
SKU	Size	Availability	Price	Qty
C608350-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,200.90
C608350-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$4,000.90

View related series

protein kinase C delta Inhibitor protein kinase C theta Inhibitor

Basic Description

Synonyms	CC-90005\|UNII-GEZ43HM6NW\|GEZ43HM6NW\|1799574-70-1\|CHEMBL4873647\|5-Pyrimidinecarbonitrile, 2-(((4-(2,2-difluoropropoxy)-5-pyrimidinyl)methyl)amino)-4-(((1R,4S)-4-hydroxy-3,3-dimethylcyclohexyl)amino)-\|SCHEMBL16822024\|GTPL11659\|BDBM50573044\|AKOS040754863\|com
Specifications & Purity	Moligand™
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of protein kinase C delta;Inhibitor of protein kinase C theta

Associated Targets

CYP2C19 Tchem Cytochrome P450 2C19 0 Activities

Discover Target: CYP2C19

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CYP2C9 Tchem Cytochrome P450 2C9 0 Activities

Discover Target: CYP2C9

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

HRH1 Tclin Histamine H1 receptor 0 Activities

Discover Target: HRH1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

PRKCD Tclin Protein kinase C delta type 0 Activities

Discover Target: PRKCD

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

KCNH2 Tclin Potassium voltage-gated channel subfamily H member 2 0 Activities

Discover Target: KCNH2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

PRKCQ Tchem Protein kinase C theta type 0 Activities

Discover Target: PRKCQ

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

IUPAC Name	2-[[4-(2,2-difluoropropoxy)pyrimidin-5-yl]methylamino]-4-[[(1R,4S)-4-hydroxy-3,3-dimethylcyclohexyl]amino]pyrimidine-5-carbonitrile
INCHI	InChI=1S/C21H27F2N7O2/c1-20(2)6-15(4-5-16(20)31)29-17-13(7-24)9-26-19(30-17)27-10-14-8-25-12-28-18(14)32-11-21(3,22)23/h8-9,12,15-16,31H,4-6,10-11H2,1-3H3,(H2,26,27,29,30)/t15-,16+/m1/s1
InChi Key	FMKGJQHNYMWDFJ-CVEARBPZSA-N
Canonical SMILES	CC(F)(F)COc1c(CNc2nc(N[C@@H]3CC[C@H](O)C(C)(C)C3)c(cn2)C#N)cncn1
Isomeric SMILES	CC1(C[C@@H](CC[C@@H]1O)NC2=NC(=NC=C2C#N)NCC3=CN=CN=C3OCC(C)(F)F)C
PubChem CID	118162109

References

1. Zhang EY, Kong KF, Altman A. (2013) The yin and yang of protein kinase C-theta (PKCθ): a novel drug target for selective immunosuppression.. Adv Pharmacol, 66 (3): (267-312). [PMID:23433459]
2. Papa P, Whitefield B, Mortensen DS, Cashion D, Huang D, Torres E, Parnes J, Sapienza J, Hansen J, Correa M et al.. (2021) Discovery of the Selective Protein Kinase C-θ Kinase Inhibitor, CC-90005.. J Med Chem, 129 (3): (589-97). [PMID:34355886]

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