Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.64 |
| ▸ | RAB9A | P51151 | 8/20 | 0.64 |
| ▸ | NPC1 | O15118 | 7/20 | 0.64 |
| ▸ | MAPT | P10636 | 5/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 3/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.52 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.52 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | DPP4 | P27487 | 1/20 | 0.50 |
| ▸ | DPP8 | Q6V1X1 | 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 | |
|---|---|---|---|---|
| SCHEMBL18976336 | 0.89 | ALDH1A1 (0.56) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| SCHEMBL7158732 | 0.81 | HTT (0.65) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| SCHEMBL14320471 | 0.79 | RAB9A (0.72) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| SCHEMBL654558 | 0.79 | MAOA (0.67) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| SCHEMBL30100149 | 0.79 | MAOA (0.67) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| SCHEMBL4001852 | 0.79 | POLB (0.69) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| SCHEMBL31290976 | 0.77 | CA12 (0.68) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| Hydrochloric Acid SCHEMBL7803214 | 0.77 | POLB (0.68) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| SCHEMBL3488219 | 0.77 | CA12 (0.68) | ALDH1A1RAB9ANPC1MAPTLMNA | |
| SCHEMBL3609153 | 0.77 | POLB (0.59) | ALDH1A1RAB9ANPC1MAPTLMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |