Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10277413 | 0.86 | ALDH1A1 (0.47) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 | |
| SCHEMBL10277355 | 0.84 | CYP1A1 (0.39) | CYP1A1CYP1B1KDM4EGCGRHDAC8 | |
| SCHEMBL10310982 | 0.81 | ALDH1A1 (0.51) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 | |
| SCHEMBL18045690 | 0.80 | ALDH1A1 (0.67) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 | |
| SCHEMBL267533 | 0.79 | ALDH1A1 (0.49) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 | |
| SCHEMBL5143351 | 0.75 | ALDH1A1 (0.67) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 | |
| SCHEMBL4059477 | 0.73 | ALDH1A1 (0.67) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 | |
| SCHEMBL20892596 | 0.73 | ALDH1A1 (0.67) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 | |
| SCHEMBL702232 | 0.72 | ALDH1A1 (0.71) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 | |
| SCHEMBL18068448 | 0.72 | ALDH1A1 (0.54) | ALDH1A1MAOBCYP1A1CYP1B1L3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2480253-A1 | ADSORPTION OF IMMUNOPOTENTIATORS TO INSOLUBLE METAL SALTS | Novartis AG (CH) | 2012-08-01 | — | — | EP | disclosed |
| WO-2012031140-A1 | ADSORPTION OF IMMUNOPOTENTIATORS TO INSOLUBLE METAL SALTS | NOVARTIS AG (CH) | 2012-03-08 | — | — | WO | disclosed |