Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RHOA | P61586 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.46 |
| ▸ | PLAU | P00749 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | GBA1 | P04062 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6235741 | 0.81 | ALDH1A1 (0.57) | NPC1RAB9APLAUCYP1A2GBA1 | |
| SCHEMBL6237367 | 0.79 | CYP1A2 (0.51) | NPC1RAB9ACYP1A2HTTALDH1A1 | |
| SCHEMBL11720346 | 0.72 | RHOA (0.63) | RHOANPC1APOBEC3ARAB9AAPOBEC3G | |
| SCHEMBL577663 | 0.71 | MAPT (0.44) | NPC1RAB9ACYP1A2HTTALDH1A1 | |
| SCHEMBL1903020 | 0.69 | LMNA (0.62) | NPC1RAB9ACYP1A2HTTALDH1A1 | |
| SCHEMBL6261454 | 0.69 | NPC1 (0.62) | NPC1RAB9ACYP1A2HTTALDH1A1 | |
| SCHEMBL6239581 | 0.69 | ABCG2 (0.54) | RHOACYP1A2HTTALDH1A1MEN1 | |
| SCHEMBL6234225 | 0.69 | ALDH1A1 (0.64) | NPC1RAB9ACYP1A2ALDH1A1KDM4E | |
| SCHEMBL7688232 | 0.69 | ACHE (0.56) | RHOANPC1APOBEC3ARAB9AAPOBEC3G | |
| SCHEMBL7696365 | 0.69 | RPS6KB2 (0.60) | NPC1RAB9ACYP1A2ALDH1A1KDM4E |
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-2005007099-A2 | PKB INHIBITORS AS ANTI-TUMOR AGENTS | IMCLONE SYSTEMS INCORPORATED (US) | 2005-01-27 | — | — | WO | disclosed |