Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | LMNA | P02545 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 6/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9445017 | 0.86 | S1PR4 (0.45) | ALDH1A1LMNAMAPTS1PR4MAPK1 | |
| SCHEMBL13334920 | 0.80 | S1PR4 (0.44) | ALDH1A1LMNAMAPTS1PR4MAPK1 | |
| SCHEMBL18342871 | 0.80 | MAPT (0.52) | ALDH1A1LMNAMAPTS1PR4MAPK1 | |
| SCHEMBL8877173 | 0.78 | S1PR4 (0.39) | ALDH1A1LMNAMAPTS1PR4KMT2A | |
| SCHEMBL9048525 | 0.77 | MAPT (0.39) | ALDH1A1LMNAMAPTS1PR4KMT2A | |
| SCHEMBL29195279 | 0.76 | LMNA (0.58) | ALDH1A1LMNAMAPTMAPK1KMT2A | |
| SCHEMBL9684646 | 0.76 | L3MBTL1 (0.39) | ALDH1A1LMNAMAPTMAPK1KMT2A | |
| SCHEMBL27346707 | 0.76 | ALDH1A1 (0.41) | ALDH1A1LMNAMAPTKMT2AHPGD | |
| SCHEMBL193774 | 0.75 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTMAPK1KMT2A | |
| SCHEMBL30127220 | 0.75 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTMAPK1KMT2A |
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-0349748-B1 | SUBSTITUTED N-ARYL-NITROGEN CONTAINING HETEROCYCLES | BAYER AG (DE) | 1992-11-19 | — | — | EP | disclosed |
| US-5118849-A | Arylamines intermediates | BAYER AKTIENGESELLSCHAFT (DE) | 1992-06-02 | — | — | US | disclosed |
| US-5039334-A | Herbicidal and plant growth-regulating substituted N-aryl nitrogen heterocycles | BAYER AKTIENGESELLSCHAFT (DE) | 1991-08-13 | — | — | US | disclosed |
| EP-0349748-A1 | Substituted N-aryl-nitrogen containing heterocycles | BAYER AG (DE) | 1990-01-10 | — | — | EP | disclosed |