Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.59 |
| ▸ | RAB9A | P51151 | 8/20 | 0.59 |
| ▸ | PKM | P14618 | 3/20 | 0.59 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11673055 | 0.98 | NPC1 (0.57) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL7091557 | 0.79 | RAB9A (0.59) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL2226467 | 0.79 | RAB9A (0.59) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL9028468 | 0.79 | RAB9A (0.70) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL10417855 | 0.79 | RAB9A (0.70) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL224101 | 0.79 | RAB9A (0.61) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL519066 | 0.77 | RAB9A (0.73) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL10788485 | 0.76 | CYP1A2 (0.61) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL11304291 | 0.76 | NPC1 (0.62) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL4541072 | 0.76 | NPC1 (0.55) | NPC1RAB9APKMGAASMN1; SMN2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4262125-A | ANTISECRETORY, HYPOTENSIVE | AMERICAN HOME PRODUCTS CORPORATION (US) | 1981-04-14 | — | — | US | claimed |
| WO-2009086835-A1 | NOVEL CYANOGUANIDINES | TOPOTARGET A/S (DK) | 2009-07-16 | — | — | WO | disclosed |
| EP-0984936-A1 | CYANOGUANIDINES AS CELL PROLIFERATION INHIBITORS | LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) | 2000-03-15 | — | — | EP | disclosed |
| WO-1998054142-A1 | CYANOGUANIDINES AS CELL PROLIFERATION INHIBITORS | Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) | 1998-12-03 | — | — | WO | disclosed |
| WO-1998054141-A1 | CYANOGUANIDINES AS CELL PROLIFERATION INHIBITORS | Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) | 1998-12-03 | — | — | WO | disclosed |
| US-4262125-A | ANTISECRETORY, HYPOTENSIVE | AMERICAN HOME PRODUCTS CORPORATION (US) | 1981-04-14 | — | — | US | disclosed |