Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.32 |
| ▸ | GABRP | O00591 | 2/20 | 0.32 |
| ▸ | GABRD | O14764 | 2/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.32 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.32 |
| ▸ | GABRE | P78334 | 2/20 | 0.32 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.32 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.32 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.32 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28281331 | 0.88 | KDM4E (0.38) | ALDH1A1MRGPRX4GABRPGABRDGABRA1 | |
| SCHEMBL2487883 | 0.86 | KDM4E (0.40) | ALDH1A1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL9630611 | 0.85 | GABRP (0.42) | ALDH1A1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL12224094 | 0.82 | SIRT6 (0.37) | ALDH1A1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL10676049 | 0.81 | SMN1; SMN2 (0.40) | ALDH1A1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL9215299 | 0.80 | GAA (0.35) | KDM4EPOLB | |
| Nitric Acid SCHEMBL7048263 | 0.78 | KDM4E (0.34) | ALDH1A1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL8660093 | 0.78 | ALDH1A1 (0.40) | ALDH1A1KDM4EDHODH | |
| SCHEMBL28281330 | 0.77 | ALDH1A1 (0.41) | ALDH1A1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL4714308 | 0.77 | KLKB1 (0.40) | ALDH1A1KLKB1CTSBMMP9DNMT1 |
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-5334576-A | Pre- and postemergence | AMERICAN CYANAMID COMPANY (US) | 1994-08-02 | — | — | US | disclosed |
| EP-0322616-A2 | Novel 5(and/or 6)substituted 2-(2-imidazolin-2-yl)nicotinic acids, esters and salts, useful as herbicidal agents and nivel intermediates for the preparation of said nicotinic acids, esters and salts | AMERICAN CYANAMID COMPANY (US) | 1989-07-05 | — | — | EP | disclosed |