SCHEMBL8669732

C[C@H](OP(=O)(OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H](O)[C@@H]1O)OP(=O)(O)O)[C@@H](O)[C@@H](O)[C@H](F)C=O

nearest known ligand 0.59

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	NT5E	P21589	1/20	0.59

▸	TGM2	P21980	1/20	0.58

▸	IMPDH2	P12268	7/20	0.57

▸	IMPDH1	P20839	2/20	0.55

▸	KRAS	P01116	6/20	0.55

▸	FUT5	Q11128	1/20	0.54

▸	TAS1R3	Q7RTX0	2/20	0.53

▸	TAS1R1	Q7RTX1	2/20	0.53

▸	HINT1	P49773	1/20	0.52

▸	P2RY2	P41231	1/20	0.51

▸	P2RY4	P51582	1/20	0.51

▸	P2RY6	Q15077	1/20	0.51

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
SCHEMBL1235770	0.93	NT5E (0.61)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL180928	0.93	NT5E (0.61)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL8582691	0.92	NT5E (0.59)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL1697432	0.88	NT5E (0.61)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL6027526	0.88	NT5E (0.61)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL1269745	0.85	NT5E (0.61)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL27688115	0.85	NT5E (0.77)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL5061620	0.84	NT5E (0.60)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL7571229	0.84	NT5E (0.60)	NT5ETGM2IMPDH2IMPDH1KRAS
SCHEMBL401416	0.83	NT5E (0.73)	NT5ETGM2IMPDH2IMPDH1KRAS

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
US-5770407-A	Process for preparing nucleotide inhibitors of glycosyltransferases	THE SCRIPPS RESEARCH INSTITUTE (US)	1998-06-23	—	—	US	claimed
US-5770407-A	Process for preparing nucleotide inhibitors of glycosyltransferases	THE SCRIPPS RESEARCH INSTITUTE (US)	1998-06-23	—	—	US	disclosed