Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 8/20 | 0.59 |
| ▸ | HTR1B | P28222 | 7/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 8/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 6/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 6/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 5/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.45 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
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 SCHEMBL5203869 | 0.99 | HTR1D (0.57) | HTR1DHTR1BADRA1AADRA2AADRA2C | |
| SCHEMBL4986530 | 0.81 | ADRA1A (0.50) | HTR1DHTR1BADRA1AADRA2AADRA2C | |
| SCHEMBL2561416 | 0.81 | HTR1D (0.50) | HTR1DHTR1BADRA1AADRA2AADRA2C | |
| SCHEMBL4992395 | 0.81 | HTR1D (0.50) | HTR1DHTR1BADRA1AADRA2AADRA2C | |
| SCHEMBL13752307 | 0.81 | HTR1D (0.50) | HTR1DHTR1BADRA1AADRA2AADRA2C | |
| SCHEMBL5200657 | 0.80 | TAAR1 (0.52) | HTR1DHTR1BADRA1AADRA2AADRA2C | |
| Hydrochloric Acid SCHEMBL3726850 | 0.80 | HTR1D (0.49) | HTR1DHTR1BADRA1AADRA2AADRA2C | |
| SCHEMBL5201030 | 0.80 | ADRA1A (0.80) | ADRA1AADRA2AADRA2CADRA1DADRA1B | |
| Hydrochloric Acid SCHEMBL5203075 | 0.79 | TAAR1 (0.51) | HTR1DHTR1BADRA1AADRA2AADRA2C | |
| SCHEMBL4993251 | 0.79 | HTR1B (0.48) | HTR1DHTR1BADRA1AADRA2AADRA2C |
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 |