Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.51 |
| ▸ | USP2 | O75604 | 4/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | APEX1 | P27695 | 1/20 | 0.51 |
| ▸ | CASP7 | P55210 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | ACHE | P22303 | 3/20 | 0.49 |
| ▸ | APP | P05067 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | CASP6 | P55212 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8890175 | 0.86 | PDE5A (0.55) | PDE5ACYP1A2CYP3A4USP2ALOX15 | |
| SCHEMBL8890389 | 0.85 | ACHE (0.48) | ACHEAPPCASP6SIRT5RAD52 | |
| Hydrochloric Acid SCHEMBL8890506 | 0.82 | POLB (0.59) | ACHEAPPCASP6SIRT5 | |
| SCHEMBL8892539 | 0.79 | NPY5R (0.60) | ALOX15TP53APPTSHRMAPK1 | |
| SCHEMBL6039576 | 0.79 | NPY5R (0.60) | ALOX15TP53APPTSHRMAPK1 | |
| SCHEMBL8891176 | 0.79 | NPY5R (0.60) | ALOX15TP53APPTSHRMAPK1 | |
| Hydrochloric Acid SCHEMBL8892580 | 0.78 | NPY5R (0.58) | ALOX15ALDH1A1TP53APPKDM4E | |
| SCHEMBL8893012 | 0.77 | ADRA2A (0.47) | — | |
| SCHEMBL8898351 | 0.76 | VCP (0.48) | PDE5ACYP1A2CYP3A4USP2ALOX15 | |
| SCHEMBL8889077 | 0.75 | VCP (0.47) | ACHEAPPCASP6MEN1KMT2A |
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-1997020821-A1 | HETEROARYL DERIVATIVES | NOVARTIS AG (CH) | 1997-06-12 | — | — | WO | disclosed |