ZINC15:Syntax

The general form of a ZINC 15 api request is

http[s]://host/resource[.format[:columns][/variant][?page-view-controls | resource-constraints]

Where items in [ square brackets ] are optional.

• host = zinc15.docking.org
• resource is one of the 15 ZINC15:Resources
• format is one of the 12 ZINC15:Formats. If omitted, a web page is requested.
• columns is one or more of the ZINC15:Columns. Not all columns make sense in all resource contexts. Examples are provided. There are sensible defaults for each resource, so the column specification may be omitted.
• variant is optionally one or more of the supported ZINC15:Variants.
• page-view-controls is optionally one or more of those listed in the page-view-controls table, below.
• resource constraints is optionally one or more of those in the resource-constraints table, below.

Format

We support the following resource constraints

format	Description	options/links
resource.attribute:operator	substance table	notes about substance table
blah	lala	lala
blah	lala	asdf
xls	asdfasdf	sdfsdfdaf
tsv	qwer34	seradsf
xml	sdfasfd	sadfasdf

Query operators

operator	Description	synonyms
@>	lala	contains
<@	lala	contained in
=	equals	eq
<	less than	lt
>	greater than	gt
<=	less than or equal	le
>=	greater than or equal	ge
between	sadfasfsd	asdfasfd
like, is, not , startswith, endswith, similar to	asdf asdf	asdfasfd sadf

NP, Drug and BB

quality	values	Notes/Links
NP	0=unknown, 1=biogenic, 2=metabolite, 3=endogenous human metabolite	lala
Drug	0=unknown, 1=annotated catalog, 2=bioactive, 4=bioactive in vitro < 1uM, 5=bioactive in cells <1uM, 6=in man, 8=world drug, 10=fda approved	lala
BB	f=not bb, t=bb	asdf

examples

http://zincapi.ucsf.bkslab.org/v1/substances/txt:smiles,zinc_id,tanimoto_similarity/catalog.purchasable%20gt%209&ecfp4.data%20similarto%20CC(=O)Oc1ccccc1C(=O)O%20within%20.5?count=all