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4-(Furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-amine

ID: ALA2153262

Chembl Id: CHEMBL2153262

PubChem CID: 52937877

Max Phase: Preclinical

Molecular Formula: C10H8N4O

Molecular Weight: 200.20

Molecule Type: Small molecule

Associated Items:

Bioactivity Summary Target Summary Assay Summary

Names and Identifiers

Canonical SMILES: Nc1nc2c(-c3ccoc3)nccc2[nH]1

Standard InChI: InChI=1S/C10H8N4O/c11-10-13-7-1-3-12-8(9(7)14-10)6-2-4-15-5-6/h1-5H,(H3,11,13,14)

Standard InChI Key: CQFBPYAEFREJQQ-UHFFFAOYSA-N

CDK5 Tchem Cyclin-dependent kinase 5/CDK5 activator 1 (3697 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PIM1 Tchem Serine/threonine-protein kinase PIM1 (9629 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CSNK1A1 Casein kinase I isoform alpha (80 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Dyrk1a Dual specificity tyrosine-phosphorylation-regulated kinase 1A (1629 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Natural Product: No	Oral: No	Chemical Probe: No	Parenteral: No
Molecule Type: Small molecule	Topical: No	First In Class: No	Black Box: No
Chirality: No	Availability: No	Prodrug: No

MESH ID	MESH Heading	EFO IDs	EFO Terms	Max Phase for Indication	References

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Molecular Weight: 200.20	Molecular Weight (Monoisotopic): 200.0698	AlogP: 1.80	#Rotatable Bonds: 1
Polar Surface Area: 80.73	Molecular Species: NEUTRAL	HBA: 4	HBD: 2
#RO5 Violations: ┄	HBA (Lipinski): 5	HBD (Lipinski): 3	#RO5 Violations (Lipinski): ┄
CX Acidic pKa: 11.21	CX Basic pKa: 5.52	CX LogP: 1.07	CX LogD: 1.06
Aromatic Rings: 3	Heavy Atoms: 15	QED Weighted: 0.63	Np Likeness Score: 0.10

1. Shengule SR, Loa-Kum-Cheung WL, Parish CR, Blairvacq M, Meijer L, Nakao Y, Karuso P.. (2011) A one-pot synthesis and biological activity of ageladine A and analogues., 54 (7): [PMID:21413800] [10.1021/jm200039m]

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