Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.32 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.32 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.32 |
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.30 |
| ▸ | RARB | P10826 | 1/20 | 0.30 |
| ▸ | RARG | P13631 | 1/20 | 0.30 |
| ▸ | RXRA | P19793 | 1/20 | 0.30 |
| ▸ | RXRB | P28702 | 1/20 | 0.30 |
| ▸ | RXRG | P48443 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10824467 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TSHRKDM4EATMNR4A1 | |
| SCHEMBL5507898 | 0.80 | KDM4E (0.34) | ALDH1A1TSHRKDM4EATMNR4A1 | |
| SCHEMBL5507895 | 0.80 | KDM4E (0.34) | ALDH1A1TSHRKDM4EATMNR4A1 | |
| SCHEMBL1783630 | 0.80 | ALDH1A1 (0.40) | ALDH1A1TSHR | |
| SCHEMBL1783632 | 0.80 | ALDH1A1 (0.40) | ALDH1A1TSHR | |
| SCHEMBL16376833 | 0.77 | ALDH1A1 (0.33) | ALDH1A1TSHRKDM4EATM | |
| SCHEMBL936907 | 0.72 | NR4A1 (0.41) | KDM4EATMNR4A1NR4A2NR4A3 | |
| SCHEMBL3454104 | 0.72 | NR4A1 (0.41) | KDM4EATMNR4A1NR4A2NR4A3 | |
| SCHEMBL936905 | 0.72 | NR4A1 (0.41) | KDM4EATMNR4A1NR4A2NR4A3 | |
| SCHEMBL10669206 | 0.72 | RIPK1 (0.36) | TSHRKDM4EATMRXRARXRB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-61065895-A | — | — | None | — | — | JP | disclosed |
| JP-61197590-A | — | — | None | — | — | JP | disclosed |
| JP-S61197590-A | QUASSINOID COMPOUND AND PRODUCTION THEREOF | SUNTORY LTD | 1986-09-01 | — | — | JP | disclosed |
| JP-S6165895-A | NOVEL QUASSINOID COMPOUND AND ITS PRODUCTION | SUNTORY LTD | 1986-04-04 | — | — | JP | disclosed |