Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.64 |
| ▸ | POLB | P06746 | 11/20 | 0.38 |
| ▸ | MAPT | P10636 | 9/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.35 |
| ▸ | HTT | P42858 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 6/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL160461 | 0.84 | — | — | |
| Furfural SCHEMBL11511062 | 0.83 | ALDH1A1 (0.44) | ALDH1A1POLBMAPTKDM4ERECQL | |
| SCHEMBL6050025 | 0.82 | — | — | |
| Water SCHEMBL27897235 | 0.82 | — | — | |
| Water SCHEMBL2308338 | 0.82 | ALDH1A1 (0.34) | ALDH1A1MAPTKDM4ELMNAMAPK1 | |
| O-Xylene SCHEMBL28533407 | 0.81 | ALDH1A1 (0.75) | ALDH1A1POLBMAPTKDM4ERECQL | |
| Bromide SCHEMBL28275344 | 0.81 | ALDH1A1 (0.33) | ALDH1A1MAPTKDM4ELMNAMAPK1 | |
| Furfural SCHEMBL20439 | 0.80 | — | — | |
| Furfural SCHEMBL10811266 | 0.80 | ALDH1A1 (1.00) | ALDH1A1POLBMAPTKDM4ERECQL | |
| Furfural SCHEMBL626705 | 0.80 | ALDH1A1 (1.00) | ALDH1A1POLBMAPTKDM4ERECQL |
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-4334905-A | STABILIZED AZULMIC ACID | BAYER AKTIENGESELLSCHAFT (DE) | 1982-06-15 | — | — | US | disclosed |
| US-4251255-A | STABILIZED, MODIFIED AZULMIC ACIDS CONDENSED WITH A CARBONYL COMPOUND | BAYER AKTIENGESELLSCHAFT (DE) | 1981-02-17 | — | — | US | disclosed |