Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 9/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL6847984 | 0.88 | KDM4E (0.44) | CYP2D6HTR1ALMNACYP2C19ALDH1A1 | |
| SCHEMBL6665709 | 0.84 | LOXL2 (0.55) | CYP2D6LOXL2NCF1HTR1AADRA1D | |
| SCHEMBL11904339 | 0.84 | LOXL2 (0.46) | CYP2D6LOXL2NCF1HTR1AADRA1D | |
| SCHEMBL14532288 | 0.84 | LOXL2 (0.48) | CYP2D6LOXL2NCF1HTR1AADRA1D | |
| SCHEMBL24700723 | 0.81 | LOXL2 (0.46) | CYP2D6LOXL2NCF1HTR1AADRA1D | |
| SCHEMBL277463 | 0.81 | LOXL2 (0.50) | CYP2D6LOXL2NCF1HTR1AADRA1D | |
| SCHEMBL7021926 | 0.81 | LOXL2 (0.46) | CYP2D6LOXL2NCF1HTR1AADRA1D | |
| SCHEMBL14431011 | 0.80 | NCF1 (0.47) | CYP2D6LOXL2NCF1HTR1AADRA1D | |
| SCHEMBL19272107 | 0.80 | NCF1 (0.47) | CYP2D6LOXL2NCF1HTR1AADRA1D | |
| SCHEMBL1496311 | 0.80 | NCF1 (0.47) | CYP2D6LOXL2NCF1HTR1AADRA1D |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1027332-A1 | NOVEL LACTAM METALLOPROTEASE INHIBITORS | Du Pont Pharmaceuticals Company (US) | 2000-08-16 | — | — | EP | disclosed |
| US-6057336-A | ANTIINFLAMMATORY AGENTS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-05-02 | — | — | US | disclosed |
| WO-1999018074-A1 | NOVEL LACTAM METALLOPROTEASE INHIBITORS | Britol-Myers Squibb Pharma Company (US) | 1999-04-15 | — | — | WO | disclosed |