Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.70 |
| ▸ | LMNA | P02545 | 2/20 | 0.70 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | CFTR | P13569 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.48 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.48 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | TSPO | P30536 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6959625 | 0.85 | ALDH1A1 (0.65) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL1162462 | 0.85 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL1567249 | 0.85 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL4430933 | 0.84 | ALDH1A1 (0.58) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL7147927 | 0.83 | ALDH1A1 (0.54) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL156281 | 0.82 | ALDH1A1 (0.66) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL70322 | 0.82 | ALDH1A1 (0.66) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL10360804 | 0.82 | ALDH1A1 (0.77) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL8877393 | 0.82 | ALDH1A1 (1.00) | ALDH1A1LMNATSHRHSD17B10CFTR | |
| SCHEMBL8201907 | 0.82 | ALDH1A1 (0.49) | ALDH1A1LMNATSHRHSD17B10CFTR |
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-110372660-A | The synthetic method of isocoumarin analog derivative | 天津大学 | 2019-10-25 | — | — | CN | disclosed |
| CN-110248940-A | Aryl hydrocarbon receptor (AhR) adjusts immunomodulator compounds | 菲尼克斯药品股份公司 | 2019-09-17 | — | — | CN | disclosed |