Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | APP | P05067 | 7/20 | 0.39 |
| ▸ | BACE1 | P56817 | 7/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL21750681 | 0.98 | MAPT (0.44) | MAPTKDM4EGAAAPPBACE1 | |
| SCHEMBL9054579 | 0.87 | MAPT (0.41) | MAPTKDM4EGAAAPPBACE1 | |
| SCHEMBL4373634 | 0.81 | LMNA (0.42) | MAPTBACE1 | |
| SCHEMBL9053722 | 0.78 | RARA (0.48) | MAPTKDM4EGAAAPPBACE1 | |
| SCHEMBL8197285 | 0.77 | AKR1B1 (0.33) | MAPTAKR1B1 | |
| SCHEMBL4372497 | 0.77 | AKR1B1 (0.31) | MAPTAKR1B1 | |
| SCHEMBL9053853 | 0.77 | ALDH1A1 (0.42) | MAPTTDP1ALDH1A1AKR1B1 | |
| SCHEMBL3177133 | 0.76 | ITGB2 (0.41) | GAAKMT2ASMN1; SMN2 | |
| SCHEMBL8101913 | 0.76 | RARB (0.53) | MAPK1TDP1ALDH1A1AKR1B1 | |
| SCHEMBL3454900 | 0.76 | APP (0.33) | APPBACE1AKR1B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5498755-A | IMINE COMPOUNDS FOR SKIN DISORDERS AND ANTIINFLAMMATORY AGENTS | ALLERGAN, INC. | 1996-03-12 | — | — | US | disclosed |
| WO-1996006070-A1 | DISUBSTITUTED ARYL AND HETEROARYL IMINES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN (US) | 1996-02-29 | — | — | WO | disclosed |