Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | PDE1A | P54750 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11233960 | 0.82 | ALDH1A1 (0.44) | GAATRPA1MEN1KMT2ANR4A1 | |
| SCHEMBL9548043 | 0.77 | RARB (0.47) | NPC1RAB9ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11234022 | 0.74 | CA1 (0.40) | GAACLCN2MRGPRX4MEN1KMT2A | |
| Chlorobenzene SCHEMBL17841044 | 0.72 | FOLH1 (0.52) | GAACLCN2MRGPRX4NR4A1NPC1 | |
| SCHEMBL27890108 | 0.72 | MYC (0.51) | GAATRPA1MEN1KMT2ARAB9A | |
| SCHEMBL28854108 | 0.71 | NR4A1 (0.58) | GAACLCN2MRGPRX4NR4A1NPC1 | |
| SCHEMBL6935726 | 0.70 | TSHR (0.59) | CLCN2MRGPRX4SMN1; SMN2 | |
| SCHEMBL5113652 | 0.70 | GABRA1 (0.68) | CLCN2MRGPRX4 | |
| SCHEMBL1457079 | 0.69 | GABRA1 (0.69) | CLCN2MRGPRX4 | |
| SCHEMBL11390813 | 0.69 | GAA (0.48) | GAAMEN1KMT2ARAB9ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4362892-A | ARALKYLANILINES, ANTICHOLESTEROL AGENTS | BEECHAM GROUP LIMITED (GB) | 1982-12-07 | — | — | US | disclosed |
| US-4206145-A | ALKANOYL-SUBSTITUTED ARALKYLAMINES | BEECHAM GROUP LIMITED (GB) | 1980-06-03 | — | — | US | disclosed |