Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GPR88 | Q9GZN0 | 4/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL7912845 | 0.97 | HTT (0.45) | HTTALDH1A1KDM4EMEN1NPC1 | |
| SCHEMBL157266 | 0.79 | HTT (0.63) | HTTALDH1A1KDM4EMEN1NPC1 | |
| SCHEMBL9716647 | 0.77 | HTT (0.74) | HTTALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL7912850 | 0.75 | HTT (0.40) | HTTALDH1A1TSHR | |
| SCHEMBL7910139 | 0.74 | HTT (0.39) | HTTALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL7911201 | 0.72 | PTGES (0.37) | HTT | |
| SCHEMBL7266946 | 0.72 | HDAC1 (0.45) | HTTALDH1A1MEN1RAB9AKMT2A | |
| SCHEMBL7267865 | 0.72 | HDAC1 (0.45) | HTTALDH1A1MEN1RAB9AKMT2A | |
| SCHEMBL7275871 | 0.72 | HDAC1 (0.45) | HTTALDH1A1MEN1RAB9AKMT2A | |
| SCHEMBL7267858 | 0.72 | HDAC1 (0.45) | HTTALDH1A1MEN1RAB9AKMT2A |
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-6211212-B1 | DRUGS WITH AMIDE AND ESTER GROUPS AS ENZYME INHIBITORS | SMITHKLINE BEECHAM P.L.C. (GB) | 2001-04-03 | — | — | US | disclosed |