Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14410259 | 0.87 | ALDH1A1 (0.55) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL14410262 | 0.83 | NOS3 (0.49) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL14486788 | 0.83 | ALDH1A1 (0.44) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL14486790 | 0.83 | ALDH1A1 (0.54) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL14410258 | 0.82 | ALDH1A1 (0.59) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL14410270 | 0.82 | ALDH1A1 (0.41) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL27750794 | 0.81 | ALDH1A1 (0.60) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL2101463 | 0.80 | ALDH1A1 (0.70) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL11779612 | 0.80 | ALDH1A1 (0.87) | ALDH1A1KDM4EKMT2AMEN1ACHE | |
| SCHEMBL3602487 | 0.79 | SIGMAR1 (0.73) | ALDH1A1KDM4EKMT2AMEN1ACHE |
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-7230001-B1 | Arylalkane, arylalkene and aryl azaalkane, medicaments containing said compounds and method for the production thereof | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2007-06-12 | — | — | US | disclosed |