Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.50 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
| ▸ | STAT3 | P40763 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.44 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13271522 | 0.89 | KDM1A (0.53) | EGFRHTTIRAK1IRAK4KDM4E | |
| SCHEMBL21884844 | 0.89 | KDM1A (0.53) | EGFRHTTIRAK1IRAK4KDM4E | |
| SCHEMBL21805911 | 0.85 | EGFR (0.49) | EGFRAOC3HTTHTR1AADRA1D | |
| SCHEMBL10296328 | 0.79 | KDM1A (0.56) | EGFRHTTIRAK1IRAK4KDM4E | |
| SCHEMBL6592222 | 0.79 | KDM1A (0.56) | EGFRHTTIRAK1IRAK4KDM4E | |
| SCHEMBL10947690 | 0.76 | ELANE (0.52) | EGFRHTTSMN1; SMN2IRAK1IRAK4 | |
| SCHEMBL28512565 | 0.76 | HTR1A (0.54) | AOC3HTTHTR1AADRA1DADRA1A | |
| SCHEMBL23652014 | 0.76 | CYP3A4 (0.55) | TLR8 | |
| SCHEMBL19060471 | 0.76 | SMN1; SMN2 (0.45) | EGFRHTTSTAT3SMN1; SMN2MAPK1 | |
| SCHEMBL12663539 | 0.76 | TLR8 (0.45) | EGFRHTTSTAT3SMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020057403-A1 | INDOLE DERIVATIVE AND MEDICAL APPLICATION THEREOF | 北京越之康泰生物医药科技有限公司 | 2020-03-26 | — | — | WO | disclosed |