Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.67 |
| ▸ | RAB9A | P51151 | 3/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | ACP1 | P24666 | 1/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.58 |
| ▸ | AURKA | O14965 | 1/20 | 0.56 |
| ▸ | PIM1 | P11309 | 1/20 | 0.56 |
| ▸ | CDK2 | P24941 | 1/20 | 0.56 |
| ▸ | GSK3B | P49841 | 1/20 | 0.56 |
| ▸ | GLS | O94925 | 2/20 | 0.54 |
| ▸ | HSPA5 | P11021 | 2/20 | 0.54 |
| ▸ | HSPA9 | P38646 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30765209 | 0.99 | NPC1 (0.65) | NPC1RAB9ALMNATSHRACP1 | |
| Hydrochloric Acid SCHEMBL20576283 | 0.99 | NPC1 (0.65) | NPC1RAB9ALMNATSHRACP1 | |
| SCHEMBL4238173 | 0.84 | NPC1 (0.65) | NPC1RAB9ALMNATSHRACP1 | |
| Hydrochloric Acid SCHEMBL20577157 | 0.83 | NPC1 (0.53) | NPC1RAB9ALMNATSHRACP1 | |
| Hydrochloric Acid SCHEMBL30765097 | 0.83 | NPC1 (0.53) | NPC1RAB9ALMNATSHRACP1 | |
| SCHEMBL20887927 | 0.82 | LMNA (0.75) | NPC1RAB9ALMNATSHRACP1 | |
| SCHEMBL28706247 | 0.81 | NPC1 (0.61) | NPC1RAB9ALMNATSHRACP1 | |
| SCHEMBL20577306 | 0.80 | TSHR (0.64) | NPC1RAB9ALMNATSHRACP1 | |
| SCHEMBL18939372 | 0.79 | CYP1A2 (0.81) | NPC1RAB9ALMNATSHRACP1 | |
| SCHEMBL18289897 | 0.79 | ACP1 (1.00) | NPC1RAB9ALMNATSHRACP1 |
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-2019149922-A1 | COMPOUNDS WHICH CAUSE DEGRADATION OF EGFR, FOR USE AGAINST CANCER | F. HOFFMANN-LA ROCHE AG (CH) | 2019-08-08 | — | — | WO | disclosed |