Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5117194 | 0.88 | GSK3B (0.39) | PTGS2ALDH1A1HSD17B10GSK3BGAA | |
| SCHEMBL5116823 | 0.83 | ALDH1A1 (0.40) | PTGS2ALDH1A1TSHRGSK3B | |
| SCHEMBL14275472 | 0.78 | GSK3B (0.41) | PTGS2HTTGSK3BGAAMEN1 | |
| SCHEMBL14051816 | 0.71 | PTGS2 (0.37) | PTGS2ALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL7754290 | 0.71 | PTGS2 (0.48) | PTGS2ALDH1A1GSK3B | |
| SCHEMBL91967 | 0.71 | PTGS2 (0.48) | PTGS2ALDH1A1GSK3B | |
| SCHEMBL278635 | 0.71 | GSK3B (0.48) | PTGS2ALDH1A1HTTHSD17B10GSK3B | |
| SCHEMBL9338651 | 0.69 | PTGS2 (0.45) | PTGS2ALDH1A1HTTHSD17B10TDP1 | |
| SCHEMBL9833136 | 0.69 | PTGS2 (0.47) | PTGS2ALDH1A1TDP1GSK3BMEN1 | |
| SCHEMBL12509969 | 0.68 | CHEK1 (0.45) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7442804-B2 | Process for the preparation of furopyrroles | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2008-10-28 | — | — | US | disclosed |