Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.48 |
| ▸ | MAPT | P10636 | 8/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29956698 | 0.81 | ALDH1A1 (0.62) | ALDH1A1MAPTCYP1A2L3MBTL1POLB | |
| SCHEMBL2559995 | 0.81 | ALDH1A1 (0.55) | ALDH1A1MAPTTDP1POLBMAPK1 | |
| SCHEMBL29952525 | 0.79 | ALDH1A1 (0.41) | ALDH1A1MAPTCYP1A2CYP2C19CYP2C9 | |
| SCHEMBL2553501 | 0.79 | ALDH1A1 (0.47) | ALDH1A1MAPTTDP1CYP1A2L3MBTL1 | |
| SCHEMBL4839769 | 0.75 | ALDH1A1 (0.58) | ALDH1A1MAPTTDP1CYP1A2L3MBTL1 | |
| SCHEMBL2560686 | 0.75 | SRC (0.45) | ALDH1A1MAPTTDP1L3MBTL1HTT | |
| SCHEMBL2650454 | 0.73 | ALDH1A1 (0.48) | ALDH1A1MAPTTDP1CYP1A2L3MBTL1 | |
| SCHEMBL29955622 | 0.72 | TACR2 (0.55) | ALDH1A1MAPTTDP1L3MBTL1HTT | |
| SCHEMBL29951459 | 0.72 | ALDH1A1 (0.44) | ALDH1A1MAPTPOLBHTTSMN1; SMN2 | |
| SCHEMBL524215 | 0.72 | KMT2A (0.55) | ALDH1A1MAPTTDP1CYP1A2L3MBTL1 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |