Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9120726 | 0.81 | CYP3A4 (0.44) | CYP3A4HTR2CHTR2BHTR1ADRD1 | |
| SCHEMBL15199238 | 0.81 | ALDH1A1 (0.37) | CYP3A4HTR2CHTR2BHTR1AADRB2 | |
| SCHEMBL12316574 | 0.78 | ALDH1A1 (0.49) | CYP3A4MAPK1MAOBALDH1A1MAPT | |
| SCHEMBL31547902 | 0.75 | ALDH1A1 (0.47) | CYP3A4MAPK1ABCB1MAOBALDH1A1 | |
| SCHEMBL31547907 | 0.75 | ALDH1A1 (0.47) | CYP3A4MAPK1ABCB1MAOBALDH1A1 | |
| SCHEMBL19011495 | 0.73 | ACHE (0.39) | MAPTPKMGAA | |
| SCHEMBL14885029 | 0.70 | CYP3A4 (0.40) | CYP3A4MAPK1ABCB1HTR2CHTR2B | |
| SCHEMBL10371800 | 0.69 | DRD2 (0.55) | DRD1CA12CA1CA2CA7 | |
| SCHEMBL14098009 | 0.69 | CYP3A4 (0.40) | CYP3A4MAPK1ABCB1ALDH1A1MEN1 | |
| SCHEMBL20354380 | 0.68 | GPX4 (0.37) | CYP3A4ALDH1A1NPC1TP53MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0409862-B1 | TOPICAL PREPARATIONS | Seton Healthcare Group plc (GB) | 1992-11-11 | — | — | EP | disclosed |
| EP-0409862-A1 | TOPICAL PREPARATIONS. | SETON HEALTHCARE GROUP PLC (GB) | 1991-01-30 | — | — | EP | disclosed |
| WO-1989008442-A1 | TOPICAL PREPARATIONS | SETON PRODUCTS LIMITED (GB) | 1989-09-21 | — | — | WO | disclosed |