Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | CCR6 | P51684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 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 | |
|---|---|---|---|---|
| SCHEMBL9803806 | 0.82 | ALDH1A1 (0.53) | ALDH1A1LMNAMAPTCYP3A4PMP22 | |
| SCHEMBL6571246 | 0.78 | ALDH1A1 (0.62) | ALDH1A1LMNAMAPTCYP3A4BLM | |
| SCHEMBL15094493 | 0.77 | MAPT (0.54) | ALDH1A1LMNAMAPTCYP3A4BLM | |
| SCHEMBL3686974 | 0.76 | ALDH1A1 (1.00) | ALDH1A1LMNAMAPTCYP3A4BLM | |
| SCHEMBL29711645 | 0.76 | ALDH1A1 (1.00) | ALDH1A1LMNAMAPTCYP3A4BLM | |
| SCHEMBL28352192 | 0.75 | ALDH1A1 (0.68) | ALDH1A1LMNAMAPTCYP3A4PMP22 | |
| Dinitolmide SCHEMBL29360311 | 0.74 | ALDH1A1 (0.68) | ALDH1A1LMNAMAPTCYP3A4PMP22 | |
| SCHEMBL2889129 | 0.74 | ALDH1A1 (0.68) | ALDH1A1LMNAMAPTCYP3A4PMP22 | |
| Dinitolmide SCHEMBL43712 | 0.74 | ALDH1A1 (0.68) | ALDH1A1LMNAMAPTCYP3A4PMP22 | |
| SCHEMBL3578232 | 0.73 | SMN1; SMN2 (0.47) | ALDH1A1LMNAMAPTKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1109550-B1 | NOVEL NITROPHENYLAZIRIDINE COMPOUNDS AND THEIR USE AS PRODRUGS | AUCKLAND UNISERVICES LTD (NZ) | 2004-11-24 | — | — | EP | claimed |