Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | KDM6B | O15054 | 1/20 | 0.40 |
| ▸ | KDM4A | O75164 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11675001 | 0.88 | ALDH1A1 (0.53) | ALDH1A1KMT2ATDP1GAAALOX15 | |
| SCHEMBL30251446 | 0.81 | ALDH1A1 (0.47) | ALDH1A1KMT2ATDP1GAAALOX15 | |
| SCHEMBL3168094 | 0.78 | NAPRT (0.39) | ALDH1A1KMT2ATDP1GAAALOX15 | |
| SCHEMBL3831520 | 0.75 | BCAT2 (0.46) | ALDH1A1KMT2ATDP1GAANPC1 | |
| SCHEMBL1449566 | 0.74 | ALDH1A1 (0.52) | ALDH1A1KMT2ATDP1GAAALOX15 | |
| SCHEMBL6372852 | 0.74 | ALDH1A1 (0.56) | ALDH1A1KMT2ATDP1GAAALOX15 | |
| SCHEMBL3998608 | 0.73 | SLC6A3 (0.65) | ALDH1A1KMT2AGAASLC6A2SLC6A4 | |
| SCHEMBL4758132 | 0.73 | SLC6A3 (0.65) | ALDH1A1KMT2AGAASLC6A2SLC6A4 | |
| SCHEMBL6436789 | 0.73 | SLC6A3 (0.65) | ALDH1A1KMT2AGAASLC6A2SLC6A4 | |
| SCHEMBL2906291 | 0.73 | SLC6A3 (0.56) | ALDH1A1KMT2ATDP1GAAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4309541-A | CHEMICAL INTERMEDIATES TO QUINAZOLINE HYPOTENSIVE AGENTS | CIBA-GEIGY CORPORATION (US) | 1982-01-05 | — | — | US | disclosed |
| US-4255429-A | HYPOTENSIVE AGENTS | CIBA-GEIGY CORPORATION (US) | 1981-03-10 | — | — | US | disclosed |
| EP-0009465-A1 | N-(1-(4-amino-2-quinazolinyl)-3 or 4-piperidyl lactames, process for their preparation and pharmaceutical compositions containing them | CIBA-GEIGY AG (CH) | 1980-04-02 | — | — | EP | disclosed |
| US-4000287-A | HYPOTENSIVES, ANTIARRHYTHMIC | CIBA-GEIGY CORPORATION (US) | 1976-12-28 | — | — | US | disclosed |