Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.80 |
| ▸ | XDH | P47989 | 1/20 | 0.77 |
| ▸ | NPC1 | O15118 | 1/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.68 |
| ▸ | RAB9A | P51151 | 1/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.68 |
| ▸ | MAPT | P10636 | 1/20 | 0.65 |
| ▸ | HTT | P42858 | 1/20 | 0.65 |
| ▸ | RECQL | P46063 | 1/20 | 0.65 |
| ▸ | ACHE | P22303 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL23268895 | 0.83 | ALDH1A1 (0.64) | ALDH1A1XDH | |
| SCHEMBL23052349 | 0.74 | POLB (0.66) | ALDH1A1XDH | |
| SCHEMBL14540721 | 0.70 | ALDH1A1 (0.66) | ALDH1A1XDHMAPT | |
| SCHEMBL1658926 | 0.70 | NT5E (0.82) | NPC1RAB9AACHE | |
| SCHEMBL23052343 | 0.69 | KDM4E (0.74) | XDHMAPT | |
| SCHEMBL27790760 | 0.69 | MAOB (0.79) | ACHE | |
| SCHEMBL14540723 | 0.69 | ALDH1A1 (0.57) | ALDH1A1XDHMAPTHTT | |
| SCHEMBL23052089 | 0.68 | KMT2A (0.71) | ALDH1A1XDH | |
| SCHEMBL21392920 | 0.68 | RAB9A (0.69) | ALDH1A1XDHNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28016739 | 0.68 | KIF11 (0.76) | NPC1RAB9AACHE |
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-2021039824-A1 | RNA METHYLTRANSFERASE INHIBITOR, SCREENING METHOD THEREFOR, ANTI-CANCER AGENT EFFICACY ASSESSMENT MARKER, AND KIT FOR EFFECTIVELY PREDICTING FTSJ1 INHIBITOR | 国立大学法人 岡山大学 | 2021-03-04 | — | — | WO | disclosed |