Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL28300971 | 0.82 | MAOA (0.34) | CYP3A4ALDH1A1TDP1TP53ALOX15 | |
| SCHEMBL28211221 | 0.80 | CYP3A4 (0.42) | CYP3A4ALDH1A1TDP1TP53DHFR | |
| SCHEMBL29236426 | 0.80 | ALDH1A1 (0.42) | CYP3A4ALDH1A1TDP1TP53ALOX15 | |
| SCHEMBL186971 | 0.79 | POLB (0.41) | CYP3A4ALDH1A1TDP1TP53DHFR | |
| SCHEMBL2013577 | 0.78 | ALDH1A1 (0.40) | CYP3A4ALDH1A1TDP1TP53ALOX15 | |
| SCHEMBL8954074 | 0.75 | DHFR (0.55) | CYP3A4ALDH1A1TDP1TP53DHFR | |
| SCHEMBL8954051 | 0.73 | CYP3A4 (0.53) | CYP3A4ALDH1A1TDP1TP53DHFR | |
| SCHEMBL21548 | 0.72 | CYP3A4 (0.40) | CYP3A4ALDH1A1TDP1TP53ALOX15 | |
| SCHEMBL27687136 | 0.72 | CYP3A4 (0.40) | CYP3A4ALDH1A1TDP1TP53ALOX15 | |
| Hydrochloric Acid SCHEMBL526312 | 0.70 | TDP1 (0.39) | CYP3A4ALDH1A1TDP1TP53ALOX15 |
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-115160374-A | Stable OLED materials and devices with improved stability | 通用显示公司 | 2022-10-11 | — | — | CN | disclosed |