Gs-6620

SCHEMBL14845664

CC(C)OC(=O)[C@@H](C)N[P@@](=O)(OC[C@H]1O[C@@](C#N)(c2ccc3c(N)ncnn23)[C@](C)(O)[C@@H]1OC(=O)C(C)C)Oc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	CYP3A4	P08684	2/20	0.41

▸	CYP2C9	P11712	2/20	0.41

▸	BTN3A1	O00481	5/20	0.38

▸	RIPK1	Q13546	3/20	0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
Gs-6620 SCHEMBL14845666	1.00	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1RIPK1
Gs-6620 SCHEMBL14845668	1.00	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1RIPK1
Gs-6620 SCHEMBL10142646	1.00	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1RIPK1
Gs-6620 SCHEMBL18293537	1.00	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1RIPK1
Gs-6620 SCHEMBL15580668	1.00	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1RIPK1
Gs-6620 SCHEMBL10142658	1.00	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1RIPK1
Gs-6620 SCHEMBL18293556	1.00	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1RIPK1
Gs-6620 SCHEMBL10142654	1.00	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1RIPK1
SCHEMBL10142738	0.95	BTN3A1 (0.36)	CYP3A4CYP2C9BTN3A1RIPK1
SCHEMBL15580644	0.95	BTN3A1 (0.36)	CYP3A4CYP2C9BTN3A1RIPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-2576534-B1	1'-SUBSTITUTED-CARBA-NUCLEOSIDE PRODRUGS FOR ANTIVIRAL TREATMENT	GILEAD SCIENCES INC (US)	2014-03-19	—	—	EP	disclosed
US-8415308-B2	1′-substituted-carba-nucleoside prodrugs for antiviral treatment	GILEAD SCIENCES, INC. (US)	2013-04-09	—	—	US	disclosed