Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 5/20 | 0.46 |
| ▸ | HTR2B | P41595 | 4/20 | 0.46 |
| ▸ | NOS1 | P29475 | 3/20 | 0.41 |
| ▸ | NOS3 | P29474 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4873514 | 0.94 | HTR2C (0.45) | HTR2CHTR2BNOS1NOS3HTR2A | |
| SCHEMBL1952765 | 0.80 | CYP3A4 (0.46) | NOS1NOS3CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL297012 | 0.78 | HTR2C (0.45) | HTR2CHTR2BNOS1NOS3HTR2A | |
| SCHEMBL8912212 | 0.77 | NOS3 (0.38) | NOS1NOS3CYP2C19CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL1456315 | 0.76 | HTR2C (0.44) | HTR2CHTR2BNOS1NOS3CYP2C19 | |
| SCHEMBL1953926 | 0.74 | CYP3A4 (0.44) | NOS1NOS3CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL5866447 | 0.73 | HTR2C (0.39) | HTR2CHTR2BNOS1NOS3HTR2A | |
| SCHEMBL1420634 | 0.72 | HTR2C (0.44) | HTR2CHTR2BNOS1NOS3TP53 | |
| SCHEMBL6616471 | 0.72 | HTR2C (0.44) | HTR2CHTR2BNOS1NOS3HTR2A | |
| SCHEMBL6158943 | 0.71 | NOS3 (0.36) | NOS1NOS3CYP2C19CYP3A4CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0808303-A1 | 5-(4-SUBST.-PIPERIDINYL-1)-3-ARYL-PENTANOIC ACID DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONIST | ZENECA LIMITED (GB) | 1997-11-26 | — | — | EP | disclosed |
| WO-1996024582-A1 | 5-(4-SUBST.-PIPERIDINYL-1)-3-ARYL-PENTANOIC ACID DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONIST | ZENECA LIMITED (GB) | 1996-08-15 | — | — | WO | disclosed |