Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL2426169 | 0.86 | ALDH1A1 (0.60) | ALDH1A1HIF1AVCAM1TDP1CA1 | |
| SCHEMBL9679775 | 0.77 | FFAR1 (0.46) | ALDH1A1FFAR1CYP3A4L3MBTL1ADRB2 | |
| SCHEMBL394329 | 0.77 | ALDH1A1 (0.64) | ALDH1A1HIF1AVCAM1TDP1CYP3A4 | |
| SCHEMBL4408381 | 0.77 | TDP1 (0.51) | ALDH1A1HIF1AVCAM1TDP1CYP3A4 | |
| SCHEMBL13622489 | 0.76 | ALDH1A1 (0.70) | ALDH1A1FFAR1TDP1ALOX15TSHR | |
| SCHEMBL4971914 | 0.76 | PIK3CA (0.45) | ALDH1A1FFAR1CYP3A4L3MBTL1ADRB2 | |
| SCHEMBL1027029 | 0.75 | ALDH1A1 (0.37) | ALDH1A1FFAR1TDP1CYP3A4ALOX15 | |
| SCHEMBL697848 | 0.74 | ALDH1A1 (0.58) | ALDH1A1HIF1AVCAM1TDP1CA1 | |
| SCHEMBL9611202 | 0.73 | FFAR1 (0.59) | ALDH1A1FFAR1TDP1CYP3A4L3MBTL1 | |
| SCHEMBL4968126 | 0.73 | CYP3A4 (0.58) | ALDH1A1FFAR1TDP1CYP3A4L3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0493650-A1 | Fluorinated acetylene-containing aromatic amines and diamines | National Starch and Chemical Investment Holding Corporation (US) | 1992-07-08 | — | — | EP | claimed |
| US-5107026-A | Fluorinated acetylene-containing aromatic amines and diamines | NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) | 1992-04-21 | — | — | US | claimed |
| EP-0493650-A1 | Fluorinated acetylene-containing aromatic amines and diamines | National Starch and Chemical Investment Holding Corporation (US) | 1992-07-08 | — | — | EP | disclosed |
| US-5107026-A | Fluorinated acetylene-containing aromatic amines and diamines | NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) | 1992-04-21 | — | — | US | disclosed |