Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | LDHA | P00338 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6178039 | 0.79 | ALDH1A1 (0.57) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| SCHEMBL6178036 | 0.79 | ALDH1A1 (0.57) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| SCHEMBL28709451 | 0.77 | HTT (0.66) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| SCHEMBL48525 | 0.77 | HTT (0.66) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| SCHEMBL240822 | 0.77 | KDM4E (0.74) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| SCHEMBL11879145 | 0.77 | HTT (0.51) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| SCHEMBL226124 | 0.76 | HTT (0.63) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| Hydrogen Sulfide SCHEMBL29062416 | 0.76 | KDM4E (0.72) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| Hydrochloric Acid SCHEMBL2022863 | 0.76 | KDM4E (0.72) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 | |
| SCHEMBL27952524 | 0.76 | KDM4E (0.72) | HTTCTBP2ALDH1A1SMN1; SMN2USP2 |
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-5508310-A | ADMINISTERING SUBSTITUTED ALDEHYDES OR KETONES WHICH CAN REACT WITH T-CELL SURFACE GROUPS TO FORM SCHIFF BASES | BURROUGHS WELLCOME CO. (US) | 1996-04-16 | — | — | US | disclosed |