Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.45 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL846827 | 0.83 | ALDH1A1 (0.47) | ALDH1A1DDB1CRBNMAPK1L3MBTL1 | |
| SCHEMBL18028243 | 0.81 | ALDH1A1 (0.46) | ALDH1A1DDB1CRBNMAPK1L3MBTL1 | |
| SCHEMBL2034491 | 0.76 | ALDH1A1 (0.50) | ALDH1A1DDB1CRBN | |
| SCHEMBL1256462 | 0.75 | ALDH1A1 (0.51) | ALDH1A1DDB1CRBNMAPK1L3MBTL1 | |
| SCHEMBL20848347 | 0.75 | CYP3A4 (0.39) | ALDH1A1DDB1CRBNKMT2A | |
| SCHEMBL3791429 | 0.74 | DDB1 (0.44) | ALDH1A1DDB1CRBNGAAPKM | |
| SCHEMBL10165238 | 0.74 | ALDH1A1 (0.44) | ALDH1A1DDB1CRBNGAAMAPK1 | |
| SCHEMBL28554039 | 0.74 | ALDH1A1 (0.47) | ALDH1A1DDB1CRBNMAPK1L3MBTL1 | |
| SCHEMBL28554038 | 0.74 | ALDH1A1 (0.47) | ALDH1A1DDB1CRBNMAPK1L3MBTL1 | |
| SCHEMBL3791427 | 0.74 | DDB1 (0.44) | ALDH1A1DDB1CRBNGAAPKM |
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-7968572-B2 | Nitrogen-containing heterocyclic compound and pharmaceutical application thereof | ONO PHARMACEUTICALS CO., LTD. (JP) | 2011-06-28 | — | — | US | disclosed |