Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | FABP3 | P05413 | 5/20 | 0.46 |
| ▸ | FABP4 | P15090 | 5/20 | 0.46 |
| ▸ | FABP5 | Q01469 | 2/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.45 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | WDR5 | P61964 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HNF4A | P41235 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ACMSD | Q8TDX5 | 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 | |
|---|---|---|---|---|
| SCHEMBL5793392 | 0.86 | ALDH1A1 (0.50) | ALDH1A1FABP3FABP4FABP5AKR1C2 | |
| SCHEMBL5820920 | 0.83 | FABP3 (0.54) | ALDH1A1FABP3FABP4FABP5AKR1C2 | |
| SCHEMBL3884497 | 0.81 | KMT2A (0.47) | ALDH1A1FABP4KMT2AMEN1POLB | |
| SCHEMBL28166374 | 0.79 | AKR1C2 (0.45) | ALDH1A1FABP4AKR1C2AKR1C1KMT2A | |
| SCHEMBL332581 | 0.78 | ALDH1A1 (0.57) | ALDH1A1FABP4LMNAMAPTWDR5 | |
| SCHEMBL18980394 | 0.77 | ALDH1A1 (0.48) | ALDH1A1KMT2AMEN1POLBLMNA | |
| SCHEMBL7528413 | 0.76 | FABP3 (0.68) | ALDH1A1FABP3FABP4FABP5AKR1C2 | |
| SCHEMBL8422568 | 0.76 | CYP3A4 (0.54) | ALDH1A1FABP4KMT2AMEN1POLB | |
| SCHEMBL31037493 | 0.76 | FABP3 (0.68) | ALDH1A1FABP3FABP4FABP5AKR1C2 | |
| SCHEMBL15057790 | 0.75 | MEN1 (0.50) | ALDH1A1FABP3FABP4FABP5AKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103649053-B | Aminomethyl quinolone compounds | 霍夫曼-拉罗奇有限公司 | 2017-07-04 | — | — | CN | disclosed |