Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9233159 | 0.78 | ALDH1A1 (0.48) | ALDH1A1AKR1C3AKR1C2RORCLMNA | |
| SCHEMBL27470290 | 0.78 | ALDH1A1 (0.44) | ALDH1A1AKR1C3AKR1C2RORCLMNA | |
| SCHEMBL18163161 | 0.77 | RORC (0.49) | ALDH1A1AKR1C3AKR1C2RORCLMNA | |
| SCHEMBL5485827 | 0.77 | ALDH1A1 (0.45) | ALDH1A1MEN1KMT2AMAPK1HTT | |
| SCHEMBL29928895 | 0.74 | ALDH1A1 (0.48) | ALDH1A1AKR1C3AKR1C2RORCLMNA | |
| SCHEMBL20568110 | 0.74 | ALDH1A1 (0.48) | ALDH1A1AKR1C3AKR1C2RORCLMNA | |
| SCHEMBL16045437 | 0.73 | L3MBTL1 (0.60) | ALDH1A1AKR1C3AKR1C2RORCLMNA | |
| SCHEMBL29451470 | 0.73 | L3MBTL1 (0.64) | ALDH1A1AKR1C3AKR1C2RORCMEN1 | |
| SCHEMBL1999857 | 0.73 | PDE7A (0.54) | ALDH1A1LMNAMEN1KMT2AMAPK1 | |
| SCHEMBL8952445 | 0.73 | RORC (0.51) | ALDH1A1AKR1C3AKR1C2RORCLMNA |
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-5067967-A | Nitro dyes for oxidation color dyes | 501 HANS SCHWARZKOPF GMBH (DE) | 1991-11-26 | — | — | US | disclosed |