Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 11/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5749058 | 0.98 | ALDH1A1 (0.51) | ALDH1A1HTTL3MBTL1KDM4EKMT2A | |
| SCHEMBL5747294 | 0.97 | ALDH1A1 (0.47) | ALDH1A1HTTL3MBTL1KDM4EKMT2A | |
| SCHEMBL5745895 | 0.90 | HRH3 (0.52) | ALDH1A1HTTL3MBTL1KDM4EHRH3 | |
| SCHEMBL5746120 | 0.89 | HRH3 (0.54) | ALDH1A1KDM4EKMT2AMEN1PKM | |
| SCHEMBL5748202 | 0.73 | HTR2A (0.45) | HRH3HRH1TP53 | |
| SCHEMBL11231045 | 0.71 | LTA4H (0.44) | ALDH1A1L3MBTL1KMT2AMEN1HRH3 | |
| SCHEMBL11669781 | 0.71 | ALDH1A1 (0.45) | ALDH1A1HTTL3MBTL1KDM4EKMT2A | |
| SCHEMBL5746264 | 0.70 | ALDH1A1 (0.54) | ALDH1A1HTTL3MBTL1KDM4EKMT2A | |
| SCHEMBL492205 | 0.69 | HRH3 (0.84) | ALDH1A1KDM4EHRH3KCNH2HRH1 | |
| SCHEMBL5747939 | 0.69 | HTR1B (0.49) | L3MBTL1KDM4EKMT2AMEN1KCNH2 |
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-1711463-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2006-10-18 | — | — | EP | disclosed |
| WO-2005077899-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2005-08-25 | — | — | WO | disclosed |