Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 6/20 | 0.54 |
| ▸ | RAB9A | P51151 | 5/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | KMO | O15229 | 1/20 | 0.53 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.52 |
| ▸ | CHRNA5 | P30532 | 4/20 | 0.52 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.52 |
| ▸ | TP53 | P04637 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | BLVRB | P30043 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4456727 | 1.00 | CA9 (0.55) | CA9NPC1RAB9AL3MBTL1KMO | |
| SCHEMBL1422372 | 0.89 | KMO (0.67) | CA9NPC1RAB9AL3MBTL1KMO | |
| SCHEMBL60783 | 0.84 | SMN1; SMN2 (0.67) | CA9NPC1RAB9AL3MBTL1KMO | |
| SCHEMBL1422760 | 0.83 | CA9 (0.65) | CA9NPC1RAB9ACHRNB2CHRNA5 | |
| SCHEMBL1422479 | 0.78 | CHRNB2 (0.64) | CA9NPC1RAB9ACHRNB2CHRNA5 | |
| Niacin SCHEMBL9231503 | 0.77 | ALDH1A1 (0.70) | KMOMAPTALDH1A1KDM4EPOLB | |
| SCHEMBL4456732 | 0.77 | CA9 (0.55) | CA9NPC1RAB9ACHRNB2CHRNA5 | |
| SCHEMBL12171569 | 0.76 | NPC1 (0.76) | NPC1RAB9AL3MBTL1KMOTP53 | |
| SCHEMBL28784577 | 0.75 | S1PR1 (0.62) | CA9NPC1RAB9ACHRNB2CHRNA5 | |
| SCHEMBL12171589 | 0.74 | SMN1; SMN2 (0.75) | CA9NPC1RAB9ACHRNB2CHRNA5 |
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-2101763-A2 | PHARMACEUTICAL COMPOSITIONS AND THEIR METHODS OF USE | Abbott Laboratories (US) | 2009-09-23 | — | — | EP | disclosed |
| WO-2008073942-A2 | PHARMACEUTICAL COMPOSITIONS AND THEIR METHODS OF USE | ABBOTT LABORATORIES (US) | 2008-06-19 | — | — | WO | disclosed |