Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.48 |
| ▸ | RAB9A | P51151 | 6/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | WNT3A | P56704 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20101049 | 0.81 | SMN1; SMN2 (0.59) | NPC1RAB9AGAAMAPTALDH1A1 | |
| SCHEMBL20101093 | 0.69 | IDO1 (0.58) | NPC1RAB9AGAAMEN1KMT2A | |
| SCHEMBL24330005 | 0.66 | RAB9A (0.58) | NPC1RAB9AGAAMAPTALDH1A1 | |
| SCHEMBL29745217 | 0.66 | ALDH1A1 (0.48) | GAAMEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL15543262 | 0.66 | ALDH1A1 (0.48) | GAAMEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL1597538 | 0.65 | PIK3CB (0.58) | NPC1RAB9AGAAMEN1KMT2A | |
| SCHEMBL21056445 | 0.65 | NPC1 (1.00) | NPC1RAB9AGAAMEN1KMT2A | |
| SCHEMBL14162063 | 0.65 | LRRK2 (0.49) | NPC1GAAALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL23247804 | 0.65 | SMN1; SMN2 (0.44) | GAAMEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL31056996 | 0.65 | ALDH1A1 (0.44) | GAAKMT2AMAPTALDH1A1CYP1A2 |
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-2018081612-A1 | COMPOUNDS AND METHODS FOR TREATING CANCER | ACTAVALON, INC. (US) | 2018-05-03 | — | — | WO | disclosed |