Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 1/20 | 0.45 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | WDR5 | P61964 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HNF4A | P41235 | 2/20 | 0.41 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | FABP4 | P15090 | 1/20 | 0.40 |
| ▸ | ALB | P02768 | 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 | |
|---|---|---|---|---|
| SCHEMBL27879744 | 0.88 | BCAT2 (0.46) | MEN1KMT2AKDM4EMAP2KEAP1 | |
| SCHEMBL15057790 | 0.86 | MEN1 (0.50) | AKR1C2AKR1C1ALDH1A1MEN1KMT2A | |
| SCHEMBL27724470 | 0.82 | GAA (0.51) | ALDH1A1MAPTGAAHPGDKDM4E | |
| SCHEMBL3884497 | 0.81 | KMT2A (0.47) | ALDH1A1MEN1KMT2AMAPTTHRB | |
| SCHEMBL28166011 | 0.79 | ALDH1A1 (0.47) | AKR1C2AKR1C1ALDH1A1MEN1KMT2A | |
| SCHEMBL29964140 | 0.79 | KEAP1 (0.46) | AKR1C2AKR1C1ALDH1A1MEN1KMT2A | |
| SCHEMBL332581 | 0.78 | ALDH1A1 (0.57) | ALDH1A1MAPTLMNAWDR5HPGD | |
| SCHEMBL2099668 | 0.78 | PIK3CA (0.37) | AKR1C2AKR1C1ALDH1A1MEN1KMT2A | |
| SCHEMBL10430504 | 0.77 | MAP2 (0.47) | ALDH1A1MEN1KMT2AMAPTTHRB | |
| SCHEMBL29137920 | 0.76 | AKR1C2 (0.42) | AKR1C2AKR1C1ALDH1A1MAPTWDR5 |
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 |