Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.61 |
| ▸ | FDPS | P14324 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.56 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.56 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.56 |
| ▸ | ABAT | P80404 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TTR | P02766 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL335717 | 1.00 | ALDH1A1 (0.68) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL793813 | 0.84 | ALDH1A1 (0.68) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL27963608 | 0.82 | ALDH1A1 (0.46) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL27476042 | 0.82 | KMT2A (0.48) | ALDH1A1TSHRAOX1HPGDCYP1A2 | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL5308959 | 0.81 | ALDH1A1 (1.00) | ALDH1A1TSHRAOX1FDPSHPGD | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL25202 | 0.81 | ALDH1A1 (1.00) | ALDH1A1TSHRAOX1FDPSHPGD | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL29364994 | 0.81 | ALDH1A1 (1.00) | ALDH1A1TSHRAOX1FDPSHPGD | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL1330962 | 0.81 | ALDH1A1 (1.00) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL31471675 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TSHRAOX1FDPSHPGD | |
| SCHEMBL11001934 | 0.80 | KMT2A (0.47) | ALDH1A1TSHRAOX1HPGDCYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115989230-A | Pyrazole [1,5-a ] pyridine compound and preparation method and application thereof | 上海艾力斯医药科技股份有限公司 | 2023-04-18 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |