Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.65 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL37125 | 0.85 | ALDH1A1 (0.63) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| Water SCHEMBL5357502 | 0.83 | ALDH1A1 (0.61) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL3413576 | 0.82 | ALDH1A1 (0.73) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL28219066 | 0.82 | ALDH1A1 (0.73) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL343011 | 0.80 | MAPT (0.77) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL28491005 | 0.80 | ALDH1A1 (0.71) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL159213 | 0.79 | ALDH1A1 (0.69) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL9248607 | 0.79 | ALDH1A1 (0.59) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL418307 | 0.79 | ALDH1A1 (0.69) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL337104 | 0.79 | ALDH1A1 (1.00) | ALDH1A1CYP3A4MEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0132865-A1 | Alpha-halogenated aromatic compounds as photoinitiators | STAUFFER CHEMICAL COMPANY (US) | 1985-02-13 | — | — | EP | disclosed |