Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | UBE2M | P61081 | 1/20 | 0.44 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.44 |
| ▸ | HTR5A | P47898 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.43 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | WNT3A | P56704 | 1/20 | 0.42 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.42 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5134630 | 0.81 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2NPSR1HPGDMAPT | |
| SCHEMBL5134793 | 0.80 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2NPSR1HPGDMAPT | |
| SCHEMBL4766559 | 0.80 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2NPSR1HPGDMAPT | |
| SCHEMBL5136876 | 0.79 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2NPSR1HPGDMAPT | |
| SCHEMBL14099478 | 0.73 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2NPSR1HPGDMAPT | |
| SCHEMBL5135714 | 0.70 | LMNA (0.45) | ALDH1A1SMN1; SMN2HPGDTSHRUBE2M | |
| SCHEMBL10120105 | 0.70 | ALDH2 (0.72) | ALDH1A1SMN1; SMN2HPGDTSHRMAPK1 | |
| SCHEMBL17072329 | 0.69 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2NPSR1HPGDMAPT | |
| SCHEMBL14586262 | 0.69 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2NPSR1HPGDMAPT | |
| SCHEMBL5136528 | 0.68 | GABRA1 (0.46) | ALDH1A1SMN1; SMN2HPGDMAPTTSHR |
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-1322309-B1 | HIGH AFFINITY SMALL MOLECULE C5A RECEPTOR MODULATORS | NEUROGEN CORP (US) | 2008-08-13 | — | — | EP | disclosed |