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Chemical Similarity
Transformation
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Prodrugs
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Metabolite Datasets
Cytochrome P450
Homo sapiens »
CYP1
CYP2
CYP3
CYP4
CYP5
CYP7
CYP8
CYP11
CYP17
CYP19
CYP20
CYP21
CYP24
CYP26
CYP27
CYP39
CYP46
CYP51
Mus musculus
Danio rerio
Oncorhynchus mykiss
Comparison of CYPs
Biochemical Action
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Target Level (ChEMBL)
Level 1
Level 2
Level 3
Level 4
Level 5
Level 6
Mechanism of action
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Mechanism of action
BLAST against human drug target
BLAST against selected species (UniProt)
Exposure
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NARAZACICLIB
Search structure
Status
Phase 1
Molecule Category
Free-form
Datasets:
Active Pharmaceutical Ingredients
Bioactive chemicals
Agrochemicals
Human Metabolites
Search:
Exact
Similarity
SubStructure
Threshold (%) >=
70
Structure
InChI Key
VADOZMZXXRBXNY-UHFFFAOYSA-N
Smiles
CN1CCN(c2ccc(Nc3ncc4cc(C#N)c(=O)n(C5CCCC5)c4n3)cc2)CC1
InChI
InChI=1S/C24H27N7O/c1-29-10-12-30(13-11-29)20-8-6-19(7-9-20)27-24-26-16-18-14-17(15-25)23(32)31(22(18)28-24)21-4-2-3-5-21/h6-9,14,16,21H,2-5,10-13H2,1H3,(H,26,27,28)
Pharmacology
Targets
EC50(nM)
IC50(nM)
Kd(nM)
Ki(nM)
Inhibition(%)
Enzyme
Kinase
Protein Kinase
CAMK protein kinase group
CAMK protein kinase CAMK1 family
CAMK protein kinase NuaK subfamily
-
4.95
-
-
-
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
CMGC protein kinase CDK family
CMGC protein kinase CDC2 subfamily
-
55-600
-
-
-
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
CMGC protein kinase CDK family
CMGC protein kinase CDK5 subfamily
-
272
-
-
-
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
CMGC protein kinase CDK family
CMGC protein kinase CDK9 subfamily
-
117
-
-
-
Enzyme
Kinase
Protein Kinase
CMGC protein kinase group
-
3.8-18
-
-
-
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase Abl family
-
53.32
-
-
-
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase FGFR family
-
26
-
-
-
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase PDGFR family
-
10-26
-
-
-
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase Src family
-
11.09
-
-
-
Enzyme
Kinase
Protein kinase regulatory subunit
-
272
-
-
-
Enzyme
Transferase
-
144
-
-
-
Other cytosolic protein
-
3.8-600
-
-
-
EC50(nM)
IC50(nM)
Kd(nM)
Ki(nM)
Inhibition(%)
Homo sapiens
-
3.8-600
-
-
-
CONTENTS
Structure
Pharmacology