Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | GSR | P00390 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL162718 | 0.73 | HRH3 (0.56) | HRH3ALDH1A1TSHRTAAR1CHRNB2 | |
| SCHEMBL27625032 | 0.71 | HRH3 (0.54) | HRH3ALDH1A1TSHRTAAR1CHRNB2 | |
| SCHEMBL1041217 | 0.71 | TSHR (0.54) | HRH3ALDH1A1TSHRTAAR1CHRNB2 | |
| SCHEMBL16324161 | 0.70 | — | — | |
| SCHEMBL659509 | 0.68 | HRH3 (0.82) | HRH3ALDH1A1TSHRTAAR1CHRNB2 | |
| SCHEMBL9244412 | 0.67 | ALDH1A1 (0.43) | HRH3ALDH1A1TSHRTAAR1CHRNB2 | |
| SCHEMBL16494971 | 0.67 | HRH3 (0.48) | HRH3ALDH1A1TSHRTAAR1CHRNB2 | |
| SCHEMBL209787 | 0.65 | CHRNB2 (0.47) | HRH3ALDH1A1TSHRTAAR1CHRNB2 | |
| SCHEMBL4933131 | 0.65 | CHRNB2 (0.42) | HRH3ALDH1A1TSHRTAAR1CHRNB2 | |
| SCHEMBL622952 | 0.65 | HRH3 (0.46) | HRH3ALDH1A1TSHRTAAR1CHRNB2 |
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-2015193255-A1 | COMPOUNDS, PHARMACEUTICAL COMPOSITION AND THEIR USE IN TREATING NEURODEGENERATIVE DISEASES | UNIVERSITE DE LILLE 2 DROIT ET SANTE (FR) | 2015-12-23 | — | — | WO | disclosed |