Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.48 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | KDM5A | P29375 | 1/20 | 0.42 |
| ▸ | JMJD1C | Q15652 | 1/20 | 0.42 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19476571 | 0.81 | HRH4 (0.52) | ADRA1DADRA1AADRA1BKDM4EKDM5A | |
| SCHEMBL9196044 | 0.77 | ADRA1D (0.52) | ADRA1DADRA1AADRA1BALDH1A1HSD17B10 | |
| SCHEMBL19477216 | 0.77 | MKNK1 (0.50) | MKNK1MKNK2KDRKDM4EKCNH3 | |
| SCHEMBL28271305 | 0.75 | HCAR3 (0.46) | KDM4EHCAR3KCNH3ALDH1A1CYP1A2 | |
| SCHEMBL3128728 | 0.75 | KDM4E (0.43) | ADRA1DADRA1AADRA1BKDRIGF1R | |
| SCHEMBL91582 | 0.75 | MKNK1 (0.51) | MKNK1MKNK2KDRKDM4EKCNH3 | |
| SCHEMBL9411677 | 0.75 | DRD2 (0.48) | ADRA1DADRA1AADRA1B | |
| SCHEMBL13728173 | 0.75 | OPRM1 (0.40) | KDRIGF1RFGFR1KDM4EALDH1A1 | |
| SCHEMBL16815659 | 0.75 | MKNK1 (0.48) | MKNK1MKNK2KDRKDM4EHCAR3 | |
| SCHEMBL28051949 | 0.74 | PTGER4 (0.47) | KDM4EHCAR3ALDH1A1UTS2RHPGD |
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-105658639-A | Alkynyl alcohols and methods of use | 豪夫迈·罗氏有限公司 | 2016-06-08 | — | — | CN | disclosed |