Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 8/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 6/20 | 0.34 |
| ▸ | NOS1 | P29475 | 6/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | SMAD3 | P84022 | 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 | |
|---|---|---|---|---|
| SCHEMBL20144721 | 0.88 | REN (0.39) | RENCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL15037978 | 0.83 | NOS3 (0.39) | RENCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL20144797 | 0.83 | BRD4 (0.42) | RENCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL20144727 | 0.82 | ALDH1A1 (0.46) | RENCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL15037991 | 0.79 | ALDH1A1 (0.40) | RENCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL14827750 | 0.77 | NOS1 (0.41) | RENCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL15037985 | 0.77 | HRH3 (0.42) | RENCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL15037711 | 0.77 | REN (0.38) | RENCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL15037984 | 0.77 | HRH3 (0.46) | RENCYP3A4BRD4ATAD2NOS3 | |
| SCHEMBL15037987 | 0.76 | HRH3 (0.48) | RENCYP3A4BRD4ATAD2NOS3 |
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-2791116-B1 | COUPLER WITH 7-AMINO-1,2,3,4-TETRAHYDROQUINOLINE STRUCTURE, DYEING COMPOSITION COMPRISING SAME, PROCESSES AND USES | OREAL (FR) | 2018-05-16 | — | — | EP | disclosed |