Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 4/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2096666 | 0.88 | SRD5A2 (0.59) | SRD5A2TAAR1IDO1LTA4HMAOB | |
| SCHEMBL1616 | 0.85 | TRPV1 (0.55) | TAAR1IDO1TRPV1ALDH1A1KIF11 | |
| SCHEMBL25191871 | 0.83 | TRPV1 (0.53) | TAAR1IDO1TRPV1ALDH1A1KIF11 | |
| Phosphine SCHEMBL28192244 | 0.83 | TRPV1 (0.53) | TAAR1IDO1TRPV1ALDH1A1KIF11 | |
| SCHEMBL5491719 | 0.80 | CYP3A4 (0.50) | IDO1ALDH1A1APP | |
| SCHEMBL5255445 | 0.79 | ALDH1A1 (0.59) | SRD5A2TAAR1IDO1LTA4HMAOB | |
| SCHEMBL7935401 | 0.79 | SRD5A2 (0.52) | SRD5A2TAAR1IDO1LTA4HMAOB | |
| SCHEMBL6547427 | 0.78 | KIF11 (0.61) | TRPV1MAOBALDH1A1KIF11 | |
| SCHEMBL5695842 | 0.78 | TRPV1 (0.50) | TAAR1TRPV1ALDH1A1KIF11KMT2A | |
| SCHEMBL5511243 | 0.77 | SRD5A2 (0.50) | SRD5A2TAAR1IDO1LTA4HMAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-5276037-A | Antiinflammatory agents, antiallergens | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-01-04 | — | — | US | disclosed |
| US-5272173-A | 5-lipoxygenase inhibitors | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-12-21 | — | — | US | disclosed |
| US-5225438-A | Lipoxygenase inhibitors for antiinflammatory agents or antiallergens | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-07-06 | — | — | US | disclosed |
| EP-0488602-A1 | Aryl derivatives | ZENECA LIMITED (GB) | 1992-06-03 | — | — | EP | disclosed |