Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.38 |
| ▸ | RAB9A | P51151 | 6/20 | 0.38 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | CNR2 | P34972 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | REN | P00797 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5327885 | 0.88 | RAB9A (0.45) | NPC1RAB9AMAPTALDH1A1PKM | |
| SCHEMBL5332136 | 0.84 | IDO1 (0.38) | NPC1RAB9AL3MBTL1SMN1; SMN2POLB | |
| SCHEMBL5334510 | 0.77 | CHRNB2 (0.38) | NPC1RAB9AMAPTALDH1A1CHRNB2 | |
| SCHEMBL5335644 | 0.77 | MAPT (0.40) | NPC1RAB9AMAPTALDH1A1CYP3A4 | |
| SCHEMBL5802338 | 0.77 | L3MBTL1 (0.38) | NPC1RAB9AMAPTL3MBTL1SMN1; SMN2 | |
| SCHEMBL5306222 | 0.76 | NOTUM (0.53) | NPC1RAB9AMAPTALDH1A1PKM | |
| SCHEMBL5802048 | 0.70 | CNR2 (0.35) | NPC1RAB9ACNR1CNR2MAPT | |
| SCHEMBL23982537 | 0.68 | CHRNB2 (0.46) | NPC1RAB9AMAPTALDH1A1PKM | |
| SCHEMBL5331361 | 0.68 | CNR2 (0.38) | NPC1RAB9ACNR1CNR2MAPT | |
| SCHEMBL3759539 | 0.67 | MEN1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007034445-A2 | NOVEL PIPERAZINE DERIVATIVES AS RENIN INHIBITORS FOR CARDIOVASCULAR EVENTS AND RENAL INSUFFICIENCY | ACTELION PHARMACEUTICALS LTD (CH) | 2007-03-29 | — | — | WO | disclosed |
| WO-2006064484-A1 | AZABICYCLONONENE DERIVATIVES AS RENIN INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2006-06-22 | — | — | WO | disclosed |