Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RHEB | Q15382 | 1/20 | 0.40 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | MAT2A | P31153 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.36 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28062885 | 0.89 | EGFR (0.46) | OXER1 | |
| SCHEMBL5241382 | 0.81 | EGFR (0.48) | GAAALDH1A1HSD17B10HIF1A | |
| SCHEMBL3907896 | 0.80 | ENPP2 (0.47) | ENPP2GAARHEBOXER1MCL1 | |
| SCHEMBL28062756 | 0.80 | HIF1A (0.41) | GAAPPARGCYP2C9HIF1A | |
| SCHEMBL7490158 | 0.79 | EGFR (0.58) | ALDH1A1 | |
| SCHEMBL28062783 | 0.79 | MAPT (0.41) | ALDH1A1CYP3A4ALOX15 | |
| SCHEMBL28062767 | 0.78 | EGFR (0.44) | OXER1 | |
| SCHEMBL1924840 | 0.78 | ENPP2 (0.45) | ENPP2GAARHEBOXER1MCL1 | |
| SCHEMBL8897563 | 0.73 | ALDH1A1 (0.39) | MAT2AALDH1A1CYP3A4ALOX15TSHR | |
| SCHEMBL8897690 | 0.72 | CYP11B2 (0.51) | GAAMAT2AALDH1A1NTRK1 |
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-105646327-A | 2-perfluoroalkyl indole derivative and synthesis method thereof | 上海大学 | 2016-06-08 | — | — | CN | disclosed |