Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 6/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5315761 | 1.00 | ALDH1A1 (0.52) | ALDH1A1CYP3A4HSD17B10HIF1ACYP1A2 | |
| Hydrochloric Acid SCHEMBL27301426 | 0.98 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HSD17B10HIF1ACYP1A2 | |
| SCHEMBL193825 | 0.94 | ALDH1A1 (0.54) | ALDH1A1CYP3A4HSD17B10HIF1ACYP1A2 | |
| SCHEMBL28305711 | 0.92 | ALDH1A1 (0.52) | ALDH1A1CYP3A4HSD17B10HIF1ACYP1A2 | |
| SCHEMBL27689981 | 0.89 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HSD17B10HIF1ACYP1A2 | |
| SCHEMBL15676841 | 0.82 | ALDH1A1 (0.40) | ALDH1A1CYP3A4HSD17B10HIF1ACYP1A2 | |
| SCHEMBL27962728 | 0.81 | ALDH1A1 (0.47) | ALDH1A1HSD17B10HIF1ACYP1A2HPGD | |
| SCHEMBL28175324 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HSD17B10HIF1ACYP1A2 | |
| SCHEMBL12600191 | 0.78 | ALDH1A1 (0.45) | ALDH1A1CA1CA2MEN1KMT2A | |
| SCHEMBL12175387 | 0.78 | ALDH1A1 (0.45) | ALDH1A1CYP3A4HSD17B10HIF1ACA1 |
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-109563035-A | The crystal form of tetracycline compound and preparation method thereof that 9- amino methyl replaces | 山东亨利医药科技有限责任公司 | 2019-04-02 | — | — | CN | claimed |