Inosine

Inosine

SCHEMBL8446030

N[C@@H](CCS)C(=O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O.OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NNMT P40261 4/20 0.55
▸ DOT1L Q8TEK3 6/20 0.54
▸ CARM1 Q86X55 4/20 0.54
▸ NSD2 O96028 3/20 0.54
▸ SETD7 Q8WTS6 3/20 0.54
▸ TRDMT1 O14717 3/20 0.54
▸ EHMT2 Q96KQ7 3/20 0.54
▸ PCMT1 P22061 2/20 0.54
▸ PRMT5 O14744 2/20 0.54
▸ INMT O95050 2/20 0.54
▸ METTL3 Q86U44 2/20 0.54
▸ PRMT1 Q99873 2/20 0.54
▸ EHMT1 Q9H9B1 2/20 0.54
▸ METTL14 Q9HCE5 2/20 0.54
▸ RNMT O43148 2/20 0.54
▸ TPMT P51580 1/20 0.54
▸ NSD1 Q96L73 1/20 0.54
▸ SETD2 Q9BYW2 1/20 0.54
▸ NSD3 Q9BZ95 1/20 0.54
▸ FASN P49327 3/20 0.53

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.

Compoundsimilaritytop predictedshared targets
Inosine SCHEMBL8446027 1.00 NNMT (0.55) NNMTDOT1LCARM1NSD2SETD7
Adenosine SCHEMBL8013455 0.88 NNMT (0.70) NNMTDOT1LCARM1NSD2SETD7
Adenosine SCHEMBL8013453 0.88 NNMT (0.70) NNMTDOT1LCARM1NSD2SETD7
Adenosine SCHEMBL6408986 0.84 NNMT (0.76) NNMTDOT1LCARM1NSD2SETD7
Adenosine SCHEMBL6408967 0.84 NNMT (0.76) NNMTDOT1LCARM1NSD2SETD7
SCHEMBL8446029 0.81 MARS1 (0.51) NNMTDOT1LCARM1NSD2SETD7
SCHEMBL855679 0.80 SLC29A1 (0.61) MAPTADORA3MAPK1ADORA2AADORA2B
Inosine SCHEMBL18048494 0.78 SLC29A1 (0.67) DOT1LKMT2ADPP4MEN1SLC28A1
Inosine SCHEMBL330178 0.78 SLC29A1 (0.75) DOT1LKMT2ADPP4MEN1SLC28A1
Inosine SCHEMBL20138477 0.78 SLC29A1 (0.75) DOT1LKMT2ADPP4MEN1SLC28A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0824345-A4 S-ADENOSYL METHIONINE REGULATION OF METABOLIC PATHWAYS AND ITS USE IN DIAGNOSIS AND THERAPY ORIDIGM CORP (US) 1999-08-25 — — EP disclosed
EP-0824345-A1 S-ADENOSYL METHIONINE REGULATION OF METABOLIC PATHWAYS AND ITS USE IN DIAGNOSIS AND THERAPY ORIDIGM CORPORATION (US) 1998-02-25 — — EP disclosed
WO-1996033703-A2 S-ADENOSYL METHIONINE REGULATION OF METABOLIC PATHWAYS AND ITS USE IN DIAGNOSIS AND THERAPY ORIDIGM CORPORATION (US) 1996-10-31 — — WO disclosed
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