Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL19210373 | 1.00 | TRPA1 (0.34) | TRPA1GAAKDM4EALDH1A1USP2 | |
| SCHEMBL27982836 | 0.82 | PNMT (0.33) | ALDH1A1 | |
| SCHEMBL8064366 | 0.79 | XDH (0.41) | GAAKDM4EALDH1A1MAPTALOX12 | |
| SCHEMBL8059571 | 0.78 | HPGD (0.33) | HPGDTSHR | |
| SCHEMBL15067098 | 0.76 | HPGD (0.35) | KDM4EALDH1A1MAPTHTTHSD17B10 | |
| SCHEMBL15067097 | 0.76 | HPGD (0.35) | KDM4EALDH1A1MAPTHTTHSD17B10 | |
| SCHEMBL15066916 | 0.72 | HPGD (0.37) | GAAKDM4EALDH1A1MAPTHTT | |
| SCHEMBL15067450 | 0.72 | ALDH1A1 (0.32) | ALDH1A1MAPT | |
| SCHEMBL17698454 | 0.72 | MAPT (0.30) | MAPTHPGD | |
| SCHEMBL15066915 | 0.72 | HPGD (0.37) | GAAKDM4EALDH1A1MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2921493-B1 | HETEROARYLPIPERIDINE AND HETEROARYLPIPERAZINE DERIVATIVES | BAYER IP GMBH (DE) | 2017-08-16 | — | — | EP | disclosed |