Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | STS | P08842 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6343232 | 0.88 | HCAR2 (0.41) | ALDH1A1HCAR2LMNATSHRESR1 | |
| Butane SCHEMBL9130076 | 0.86 | HCAR2 (0.40) | ALDH1A1HCAR2LMNATSHRESR1 | |
| SCHEMBL28325651 | 0.84 | NAAA (0.52) | ALDH1A1HCAR2LMNATSHRMAPT | |
| SCHEMBL12582817 | 0.82 | HCAR2 (0.42) | ALDH1A1HCAR2LMNATSHRESR1 | |
| SCHEMBL6343233 | 0.82 | HCAR2 (0.42) | ALDH1A1HCAR2LMNATSHRESR1 | |
| SCHEMBL1340978 | 0.81 | ALDH1A1 (0.48) | ALDH1A1LMNATSHRHSD17B10SMN1; SMN2 | |
| SCHEMBL11878447 | 0.80 | CA1 (0.39) | ALDH1A1HCAR2LMNATSHRESR1 | |
| Hydrochloric Acid SCHEMBL1340977 | 0.79 | ALDH1A1 (0.46) | ALDH1A1LMNATSHRHSD17B10SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9082110 | 0.79 | ALDH1A1 (0.46) | ALDH1A1LMNATSHRHSD17B10SMN1; SMN2 | |
| SCHEMBL8717353 | 0.78 | ALDH1A1 (0.42) | ALDH1A1HCAR2LMNATSHRESR1 |
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-108137606-A | Short-acting benzodiazepine * * derivatives, Its Preparation Method And Use | 四川科伦博泰生物医药股份有限公司 | 2018-06-08 | — | — | CN | claimed |
| CN-108137606-A | Short-acting benzodiazepine * * derivatives, Its Preparation Method And Use | 四川科伦博泰生物医药股份有限公司 | 2018-06-08 | — | — | CN | disclosed |