Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAD52 | P43351 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 9/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 9/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 9/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 8/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 7/20 | 0.46 |
| ▸ | HTR1D | P28221 | 5/20 | 0.46 |
| ▸ | HTR1B | P28222 | 4/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5200588 | 0.99 | RAD52 (0.47) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| SCHEMBL4992620 | 0.90 | ADRA1D (0.49) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| SCHEMBL5200888 | 0.86 | RAD52 (0.49) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| SCHEMBL5203274 | 0.85 | ADRA1A (0.55) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| SCHEMBL5203954 | 0.85 | ADRA1A (0.51) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| Hydrochloric Acid SCHEMBL5201249 | 0.85 | RAD52 (0.48) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| Bromide SCHEMBL5200819 | 0.84 | ADRA1A (0.56) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| Hydrochloric Acid SCHEMBL5205831 | 0.84 | ADRA1A (0.50) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| SCHEMBL4993472 | 0.84 | RAD52 (0.49) | RAD52TAAR1CYP2D6NFKB1ADRA1D | |
| SCHEMBL5200788 | 0.83 | HTR1B (0.51) | RAD52TAAR1CYP2D6NFKB1ADRA1D |
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-0887346-B1 | N-Phenyl-alkylsulfonamide derivatives, their preparation and their use as alpha1A/1L adrenoceptor agonists | HOFFMANN LA ROCHE (CH) | 2007-12-12 | — | — | EP | disclosed |