Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | PLAU | P00749 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | PLG | P00747 | 1/20 | 0.32 |
| ▸ | PLAT | P00750 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11073867 | 0.89 | CYP1A2 (0.35) | CYP1A2CYP3A4CYP2C19APOBEC3AAPOBEC3G | |
| SCHEMBL11072501 | 0.88 | ALDH1A1 (0.36) | CYP1A2CYP3A4CYP2C19APOBEC3AAPOBEC3G | |
| Eflumast SCHEMBL1230501 | 0.87 | PKM (0.32) | CYP1A2CYP3A4CYP2C19RAB9ANPC1 | |
| SCHEMBL11071199 | 0.86 | MEN1 (0.35) | CYP1A2CYP3A4CYP2C19APOBEC3AAPOBEC3G | |
| SCHEMBL11073948 | 0.86 | CXCR2 (0.37) | CYP1A2CYP3A4CYP2C19APOBEC3AAPOBEC3G | |
| SCHEMBL11065956 | 0.86 | CYP1A2 (0.35) | CYP1A2CYP3A4CYP2C19APOBEC3AAPOBEC3G | |
| SCHEMBL11067331 | 0.86 | MEN1 (0.35) | CYP1A2MEN1KMT2ARAB9AALDH1A1 | |
| SCHEMBL11072324 | 0.86 | CYP1A2 (0.30) | CYP1A2CYP3A4CYP2C19GAACYP2C9 | |
| SCHEMBL11070064 | 0.85 | CYP1A2 (0.34) | CYP1A2CYP3A4CYP2C19APOBEC3AAPOBEC3G | |
| Hydrochloric Acid SCHEMBL11065854 | 0.85 | — | — |
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-0323885-A1 | New chemical process | MAY & BAKER LIMITED (GB) | 1989-07-12 | — | — | EP | claimed |
| US-4442115-A | ANTI-ASTHMA | MAY & BAKER LIMITED (GB) | 1984-04-10 | — | — | US | claimed |
| EP-0323885-A1 | New chemical process | MAY & BAKER LIMITED (GB) | 1989-07-12 | — | — | EP | disclosed |
| US-4442115-A | ANTI-ASTHMA | MAY & BAKER LIMITED (GB) | 1984-04-10 | — | — | US | disclosed |