Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 10/20 | 0.50 |
| ▸ | MAOB | P27338 | 10/20 | 0.50 |
| ▸ | CA12 | O43570 | 4/20 | 0.46 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | CA9 | Q16790 | 4/20 | 0.46 |
| ▸ | PREP | P48147 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4786577 | 0.91 | CA12 (0.48) | MAOAMAOBCA12CA1CA9 | |
| SCHEMBL5405281 | 0.89 | MAOB (0.50) | MAOAMAOBCA12CA1CA9 | |
| SCHEMBL6113027 | 0.86 | MAOB (0.50) | MAOAMAOBCA12CA1CA9 | |
| SCHEMBL24529065 | 0.79 | MAOB (0.48) | MAOAMAOBCA12CA1CA9 | |
| SCHEMBL8771897 | 0.77 | CA12 (0.43) | CA12CA1CA9PREPMEN1 | |
| SCHEMBL6198684 | 0.77 | MAPT (0.44) | MAOAMAOBCA12CA1CA9 | |
| SCHEMBL4327299 | 0.77 | DRD2 (0.48) | MEN1KMT2A | |
| SCHEMBL29726357 | 0.77 | MAOB (0.58) | MAOAMAOBCYP2A6HRH3 | |
| SCHEMBL120284 | 0.77 | MAOB (0.58) | MAOAMAOBCYP2A6HRH3 | |
| SCHEMBL5188491 | 0.75 | HSD17B1 (0.42) | MAOAMEN1MAPK1KMT2ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0931086-B1 | TETRAHYDRONAPHTHALENE DERIVATIVES AND THEIR THERAPEUTIC USE | DARWIN DISCOVERY LTD (GB) | 2002-05-02 | — | — | EP | disclosed |
| US-6133240-A | INHIBITION OF SELECTINS, AND THUS OF CELL ADHESION | DARWIN DISCOVERY, LTD. (GB) | 2000-10-17 | — | — | US | disclosed |