Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 14/20 | 0.61 |
| ▸ | RAB9A | P51151 | 14/20 | 0.61 |
| ▸ | MAPT | P10636 | 7/20 | 0.61 |
| ▸ | TP53 | P04637 | 6/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | HTT | P42858 | 3/20 | 0.61 |
| ▸ | PKM | P14618 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.54 |
| ▸ | RELA | Q04206 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | GFER | P55789 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7447463 | 0.84 | NPC1 (0.72) | NPC1RAB9AMAPTTP53KDM4E | |
| SCHEMBL4320699 | 0.84 | KLK1 (0.71) | NPC1RAB9AMAPTTP53KDM4E | |
| SCHEMBL30583224 | 0.84 | KLK1 (0.71) | NPC1RAB9AMAPTTP53KDM4E | |
| Hydrochloric Acid SCHEMBL7408509 | 0.83 | KLK1 (0.70) | NPC1RAB9AMAPTTP53KDM4E | |
| SCHEMBL7415011 | 0.78 | ALOX5AP (0.52) | NPC1RAB9AMAPTTP53KDM4E | |
| SCHEMBL6779729 | 0.76 | NPC1 (0.60) | NPC1RAB9AMAPTTP53KDM4E | |
| SCHEMBL2565995 | 0.76 | RAB9A (1.00) | NPC1RAB9AMAPTTP53KDM4E | |
| SCHEMBL14914339 | 0.76 | HDAC6 (0.51) | NPC1RAB9AMAPTTP53KDM4E | |
| SCHEMBL6779723 | 0.75 | HDAC6 (0.49) | NPC1RAB9AMAPTTP53KDM4E | |
| SCHEMBL6634815 | 0.74 | NPC1 (0.52) | NPC1RAB9AMAPTTP53KDM4E |
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-1095025-B1 | BENZIMIDAZOLES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA (DE) | 2002-12-11 | — | — | EP | disclosed |
| US-6248770-B1 | CARDIOVASCULAR DISORDERS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-06-19 | — | — | US | disclosed |