Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.65 |
| ▸ | HRH1 | P35367 | 2/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.54 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL151822 | 0.97 | LOXL2 (0.68) | LOXL2HRH1HRH3HRH4CYP1A2 | |
| Water SCHEMBL31124596 | 0.93 | LOXL2 (0.65) | LOXL2HRH1HRH3HRH4CYP1A2 | |
| Water SCHEMBL31124597 | 0.93 | LOXL2 (0.65) | LOXL2HRH1HRH3HRH4CYP1A2 | |
| SCHEMBL10450404 | 0.88 | LOXL2 (0.59) | LOXL2HRH1HRH3HRH4CYP1A2 | |
| SCHEMBL15648770 | 0.88 | LOXL2 (0.59) | LOXL2HRH1HRH3HRH4CYP1A2 | |
| SCHEMBL9114210 | 0.85 | CYP1A2 (0.65) | LOXL2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| Ammonia Solution, Strong SCHEMBL4841984 | 0.84 | GFER (0.67) | LOXL2HRH1HRH3HRH4CYP3A4 | |
| SCHEMBL726645 | 0.84 | HRH1 (0.73) | LOXL2HRH1HRH3HRH4CYP1A2 | |
| SCHEMBL351920 | 0.84 | HRH1 (0.65) | LOXL2HRH1HRH3HRH4CYP1A2 | |
| Bromide SCHEMBL10614809 | 0.83 | CYP1A2 (0.63) | LOXL2CYP1A2CYP3A4CYP2D6CYP2C9 |
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-5324493-A | Using 1,2-bis/4-pyridyl/ ethane as template | BASF AKTIENGESELLSCHAFT (DE) | 1994-06-28 | — | — | US | disclosed |