Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 6/20 | 0.39 |
| ▸ | ACHE | P22303 | 6/20 | 0.39 |
| ▸ | BACE1 | P56817 | 6/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8453440 | 0.78 | HTT (0.48) | HTTDPP7HRH3EPHX1HPGD | |
| SCHEMBL8459145 | 0.77 | HTT (0.56) | HTTDPP7BCHEACHEBACE1 | |
| SCHEMBL27418792 | 0.76 | CHRNB2 (0.44) | HTTDPP7BCHEACHEBACE1 | |
| Hydrochloric Acid SCHEMBL27395800 | 0.75 | CHRNB2 (0.42) | HTTDPP7HRH3 | |
| Hydrochloric Acid SCHEMBL27284977 | 0.75 | CHRNB2 (0.42) | HTTDPP7HRH3 | |
| SCHEMBL10700286 | 0.73 | KMT2A (0.47) | HTTHRH3HPGDCXCR4 | |
| SCHEMBL9840998 | 0.73 | KMT2A (0.47) | HTTHRH3HPGDCXCR4 | |
| SCHEMBL9841000 | 0.70 | DPP4 (0.42) | DPP7BCHEACHEBACE1HRH3 | |
| SCHEMBL17805425 | 0.69 | TACR1 (0.46) | — | |
| SCHEMBL18801726 | 0.69 | TACR1 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5837715-A | 3-fluoro-4-aminopiperidine derivatives as 5-HT receptor agonists | MERCK SHARP & DOHME LTD. (GB) | 1998-11-17 | — | — | US | disclosed |