Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.46 |
| ▸ | GJB2 | P29033 | 4/20 | 0.41 |
| ▸ | GBA1 | P04062 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.35 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.35 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.35 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.35 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.35 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 2/20 | 0.33 |
| ▸ | PLCG2 | P16885 | 1/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6380820 | 0.89 | TNF (0.56) | TNFGJB2GBA1ALDH1A1TDP1 | |
| SCHEMBL6380615 | 0.86 | TNF (0.60) | TNFGJB2GBA1ALDH1A1TDP1 | |
| SCHEMBL6383580 | 0.85 | TNF (0.46) | TNFGJB2GBA1MAPK1 | |
| SCHEMBL6380648 | 0.80 | TNF (0.50) | TNFGJB2GBA1ALDH1A1TDP1 | |
| SCHEMBL6384903 | 0.79 | TNF (0.55) | TNFGJB2GBA1MAPK1 | |
| SCHEMBL6383996 | 0.77 | TNF (0.37) | TNFGJB2GBA1SSTR1SSTR2 | |
| SCHEMBL28296339 | 0.77 | GBA1 (0.51) | TNFGJB2GBA1MAPK1 | |
| SCHEMBL12777881 | 0.76 | TNF (0.57) | TNFGJB2GBA1SSTR1SSTR2 | |
| SCHEMBL14417482 | 0.76 | TNF (0.57) | TNFGJB2GBA1SSTR1SSTR2 | |
| SCHEMBL14302426 | 0.76 | TNF (0.57) | TNFGJB2GBA1SSTR1SSTR2 |
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-1001961-B1 | SUBSTITUTED TETRAHYDROPYRANE DERIVATIVES AND METHOD FOR PRODUCING SAME | AVENTIS PHARMA GMBH (DE) | 2005-01-26 | — | — | EP | disclosed |
| US-6756489-B1 | PROTECTED MONOSACCHARIDES HAVING AN ALLYL PROTECTING GROUP, A SILANE-PROTECTED HYDROXY GROUP AND A CARBOXY OR AMIDE CONTAINING PROTECTIVE GROUP; EASILY MADE BY COMBINATORIAL CHEMISTRY; APPLICATIONS TO AUTOIMMUNE AND CANCER | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2004-06-29 | — | — | US | disclosed |