Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 1.00 |
| ▸ | MEN1 | O00255 | 6/20 | 0.79 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.79 |
| ▸ | NPC1 | O15118 | 6/20 | 0.79 |
| ▸ | RAB9A | P51151 | 6/20 | 0.79 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.79 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.77 |
| ▸ | HTT | P42858 | 3/20 | 0.77 |
| ▸ | GAA | P10253 | 1/20 | 0.77 |
| ▸ | LMNA | P02545 | 3/20 | 0.71 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.71 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.71 |
| ▸ | MAPT | P10636 | 2/20 | 0.68 |
| ▸ | GFER | P55789 | 1/20 | 0.68 |
| ▸ | TP53 | P04637 | 2/20 | 0.62 |
| ▸ | CASP3 | P42574 | 1/20 | 0.62 |
| ▸ | CASP2 | P42575 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL1929165 | 0.85 | NPC1 (0.85) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL31228835 | 0.84 | NPC1 (0.82) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL19392293 | 0.84 | NPC1 (0.89) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8771200 | 0.84 | NPC1 (0.89) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL6669304 | 0.83 | HTT (1.00) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL4964101 | 0.82 | HTT (0.97) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL2063276 | 0.82 | NPC1 (0.86) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL6804148 | 0.81 | NPC1 (0.77) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL22804218 | 0.81 | NPC1 (0.83) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8770282 | 0.81 | MEN1 (0.85) | ALDH1A1MEN1KMT2ANPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013138341-A1 | TOPK INHIBITING COMPOUNDS | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2013-09-19 | — | — | WO | disclosed |
| EP-1453828-A2 | AZABICYCLIC COMPOUNDS FOR THE TREATMENT OF FIBROMYALGIA SYNDROME | AstraZeneca AB (SE) | 2004-09-08 | — | — | EP | disclosed |
| WO-2003032897-A2 | AZABICYCLIC COMPOUNDS FOR THE TREATMENT OF FIBROMYALGIA SYNDROME | ASTRAZENECA AB (SE) | 2003-04-24 | — | — | WO | disclosed |