Compound Detail

CHEMBL1258528

PONKORANOL

Enter ChEMBL ID:

Free Research Context This compound will appear in recent viewed items on the research home for this browser.

O=S(=O)([O-])O[C@@H]([C@H](O)[C@@H](O)CO)[C@H](O)C[S@+]1C[C@@H](O)[C@H](O)[C@H]1CO

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL1258528
Name	PONKORANOL
Phase	Preclinical
Structure Type	MOL
InChI Key	YCUKGYWMYZBCGT-MJYKKNOESA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

394.4

MW (Da)

-5.38

ALogP

HBA

HBD

208.0

PSA (Å²)

0.11

QED

Ro5 Violations

Rot. Bonds

Natural Product First in Class Prodrug

IC50 3 meas. best 6.54

Ki 1 meas. best 6.77

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Maltase-glucoamylase CHEMBL2074	Ki	6.77	6.77	170.0	1
Sucrase-isomaltase, intestinal CHEMBL3114	IC50	6.54	6.06	290.0	2
Acidic alpha-glucosidase CHEMBL3513	IC50	5.5	5.5	3200.0	1

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Maltase-glucoamylase	Ki	=	170.0	nM	6.77	Inhibition of human recombinant N-terminal domain of maltase-glucoamylase after ...	20801033
Sucrase-isomaltase, intestinal	IC50	=	290.0	nM	6.54	Inhibition of rat intestinal sucrase	21345683
Sucrase-isomaltase, intestinal	IC50	=	2600.0	nM	5.58	Inhibition of rat intestinal isomaltase	21345683
Acidic alpha-glucosidase	IC50	=	3200.0	nM	5.5	Inhibition of rat intestinal maltase	21345683

PubMed	DOI	Target Context	# Activities
21345683	10.1016/j.bmc.2011.01.052	Sucrase-isomaltase, intestinal	2
20801033	10.1016/j.bmcl.2010.08.020	Maltase-glucoamylase	1
21345683	10.1016/j.bmc.2011.01.052	Acidic alpha-glucosidase	1
21420866	10.1016/j.bmc.2011.02.028	Acidic alpha-glucosidase	1
21420866	10.1016/j.bmc.2011.02.028	Sucrase-isomaltase, intestinal	1

Data from ChEMBL 36 via Core Engine