Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | GLA | P06280 | 1/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11490890 | 0.87 | ADRA2C (0.63) | ALDH1A1GLABRD4HRH3ADRB2 | |
| SCHEMBL11490885 | 0.87 | BRD4 (0.47) | ALDH1A1GLABRD4HRH3ADRB2 | |
| SCHEMBL22357196 | 0.86 | ALDH1A1 (0.78) | ALDH1A1GLATDP1HRH3ADRB2 | |
| SCHEMBL679937 | 0.86 | ALDH1A1 (0.78) | ALDH1A1GLATDP1HRH3ADRB2 | |
| SCHEMBL1710088 | 0.85 | ALDH1A1 (0.68) | ALDH1A1GLATDP1BRD4HRH3 | |
| SCHEMBL14804190 | 0.84 | MAPT (0.51) | ALDH1A1GLABRD4HRH3MAPT | |
| SCHEMBL11403648 | 0.84 | NPC1 (0.48) | ALDH1A1GLABRD4HRH3MAPT | |
| SCHEMBL17955420 | 0.83 | HRH3 (0.64) | ALDH1A1GLATDP1BRD4HRH3 | |
| SCHEMBL2346726 | 0.81 | HPGD (0.46) | ALDH1A1GLABRD4HRH3MAPT | |
| SCHEMBL10803090 | 0.81 | ALDH1A1 (0.66) | ALDH1A1GLATDP1HRH3ADRB2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-56059771-A | — | — | None | — | — | JP | disclosed |
| JP-S5659771-A | PREPARATION OF MORPHOLINE DERIVATIVE | YOSHITOMI PHARMACEUT IND LTD | 1981-05-23 | — | — | JP | disclosed |