Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9272265 | 0.86 | ALDH1A1 (0.60) | ALDH1A1MAPTGAAHDAC8HPGD | |
| SCHEMBL30051464 | 0.86 | ALDH1A1 (0.60) | ALDH1A1MAPTGAAHDAC8HPGD | |
| SCHEMBL7357698 | 0.86 | ALDH1A1 (0.60) | ALDH1A1MAPTGAAHDAC8HPGD | |
| SCHEMBL6976264 | 0.86 | ALDH1A1 (0.60) | ALDH1A1MAPTGAAHDAC8HPGD | |
| SCHEMBL4891798 | 0.85 | ALDH1A1 (0.58) | ALDH1A1MAPTGAAHDAC8HPGD | |
| SCHEMBL6444839 | 0.80 | ALDH1A1 (0.58) | ALDH1A1MAPTGAAHDAC8HPGD | |
| SCHEMBL561849 | 0.80 | ALDH1A1 (0.58) | ALDH1A1MAPTGAAHDAC8HPGD | |
| Hydrochloric Acid SCHEMBL4862500 | 0.79 | ALDH1A1 (0.57) | ALDH1A1MAPTGAAHDAC8HPGD | |
| SCHEMBL12043742 | 0.78 | HDAC8 (0.65) | ALDH1A1MAPTGAAHDAC8HPGD | |
| SCHEMBL8667829 | 0.78 | ALDH1A1 (0.56) | ALDH1A1MAPTGAAHDAC8HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-1353607-A | Improved pharmaceutical formulations | ABBOTT LAB (US) | 2002-06-12 | — | — | CN | claimed |