Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 6/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CDC42 | P60953 | 1/20 | 0.36 |
| ▸ | RAC1 | P63000 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ACSS2 | Q9NR19 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 4/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5749684 | 0.99 | AKR1C3 (0.37) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL7817687 | 0.97 | LMNA (0.36) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL5748920 | 0.89 | PTGS2 (0.38) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL5682208 | 0.86 | AKR1C3 (0.40) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL7809863 | 0.84 | PTGS2 (0.36) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL7826098 | 0.80 | CYP11B2 (0.39) | CYP1A2NPC1RAB9ASIRT2 | |
| SCHEMBL8147914 | 0.76 | FNTA (0.36) | ACSS2SIRT2 | |
| SCHEMBL8147915 | 0.76 | FNTA (0.36) | ACSS2SIRT2 | |
| SCHEMBL5678248 | 0.75 | AKR1C3 (0.44) | AKR1C3AKR1C2LMNARAB9AACSS2 | |
| SCHEMBL7169255 | 0.74 | SIRT2 (0.40) | AKR1C3AKR1C2PTGS1ACSS2SIRT2 |
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-1073640-A1 | NAPHTHALENE DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 2001-02-07 | — | — | EP | disclosed |
| WO-1999054309-A1 | NAPHTHALENE DERIVATIVES, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-10-28 | — | — | WO | disclosed |