Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 5/20 | 0.57 |
| ▸ | LMNA | P02545 | 5/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | CASP3 | P42574 | 1/20 | 0.57 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.57 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.57 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | PDE1A | P54750 | 1/20 | 0.38 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3401780 | 0.80 | AOC3 (0.51) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL972133 | 0.79 | NPC1 (0.59) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL973715 | 0.78 | AOC3 (0.60) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL12947802 | 0.76 | NPC1 (0.56) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL3406288 | 0.76 | NPC1 (0.58) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL3405939 | 0.76 | RAB9A (0.77) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL12947687 | 0.75 | AOC3 (0.54) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL3406292 | 0.71 | SMN1; SMN2 (0.54) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL6796683 | 0.71 | NPC1 (0.77) | HTTLMNANPC1RAB9AALDH1A1 | |
| SCHEMBL4871628 | 0.71 | RAB9A (1.00) | HTTLMNANPC1RAB9AALDH1A1 |
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-2252604-A1 | THIAZOLE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR | R-Tech Ueno, Ltd. (JP) | 2010-11-24 | — | — | EP | disclosed |
| WO-2009096609-A1 | THIAZOLE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR | R-TECH UENO, LTD. (JP) | 2009-08-06 | — | — | WO | disclosed |