Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.39 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11724960 | 0.85 | AKR1C3 (0.60) | AKR1C3AKR1C2TSHRALDH1A1LMNA | |
| SCHEMBL11719797 | 0.84 | AKR1C3 (0.45) | AKR1C3AKR1C2TSHRALDH1A1LMNA | |
| SCHEMBL11720900 | 0.84 | THRA (0.41) | TSHRALDH1A1LMNATP53NPC1 | |
| SCHEMBL11720918 | 0.83 | FAAH (0.40) | AKR1C3AKR1C2TSHRALDH1A1LMNA | |
| SCHEMBL11723982 | 0.82 | APP (0.42) | TSHRALDH1A1LMNANPC1RAB9A | |
| SCHEMBL11725310 | 0.82 | LMNA (0.37) | TSHRALDH1A1LMNATP53 | |
| SCHEMBL11469519 | 0.82 | AKR1C3 (0.55) | AKR1C3AKR1C2TSHRLMNAESR1 | |
| SCHEMBL11717864 | 0.81 | AKR1C3 (0.40) | AKR1C3AKR1C2MAPK1NPC1RAB9A | |
| SCHEMBL11719717 | 0.81 | SMN1; SMN2 (0.41) | AKR1C3AKR1C2TSHRALDH1A1MAPK1 | |
| SCHEMBL11726834 | 0.80 | ALDH1A1 (0.44) | AKR1C3AKR1C2ALDH1A1MAPK1ESR1 |
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-4048330-A | Compositions containing 2-(6'-substituted-2'-naphthyl)acetic acid esters used for treating inflammation, pain or pyrexia | SYNTEX CORPORATION (US) | 1977-09-13 | — | — | US | disclosed |
| US-4009197-A | 2-(6-Substituted-2'-naphthyl) acetic acid derivatives and the salts and esters thereof | SYNTEX CORPORATION (PM) | 1977-02-22 | — | — | US | disclosed |