Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.58 |
| ▸ | MAOA | P21397 | 3/20 | 0.58 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.49 |
| ▸ | DRD2 | P14416 | 3/20 | 0.49 |
| ▸ | DRD3 | P35462 | 3/20 | 0.49 |
| ▸ | PNMT | P11086 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 5/20 | 0.44 |
| ▸ | MMP2 | P08253 | 5/20 | 0.44 |
| ▸ | MMP9 | P14780 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8204190 | 1.00 | MAOB (0.58) | MAOBMAOAROCK2DRD2DRD3 | |
| SCHEMBL8181093 | 0.85 | MMP1 (0.56) | MAOBMAOAPNMTHDAC4MMP1 | |
| SCHEMBL8181099 | 0.85 | MMP1 (0.56) | MAOBMAOAPNMTHDAC4MMP1 | |
| SCHEMBL8203923 | 0.82 | MAOB (0.55) | MAOBMAOAROCK2DRD2DRD3 | |
| SCHEMBL8203925 | 0.82 | MAOB (0.55) | MAOBMAOAROCK2DRD2DRD3 | |
| SCHEMBL8208790 | 0.81 | MAOB (0.53) | MAOBMAOAROCK2DRD2DRD3 | |
| SCHEMBL8208796 | 0.81 | MAOB (0.53) | MAOBMAOAROCK2DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL1189684 | 0.77 | MEN1 (0.60) | ROCK2DRD2DRD3PNMTCYP3A4 | |
| SCHEMBL8205382 | 0.76 | MMP1 (0.46) | MAOBMAOAACHEMMP1MMP2 | |
| SCHEMBL8205385 | 0.76 | MMP1 (0.46) | MAOBMAOAACHEMMP1MMP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000007993-A1 | SUBSTITUTED ISOQUINOLEINES AND THEIR USE AS ANTICONVULSIVANTS | SMITHKLINE BEECHAM PLC (GB) | 2000-02-17 | — | — | WO | claimed |
| US-6068847-A | RETINOID-CONTAINING SKIN CARE FORMULA THAT EXHIBIT GOOD EFFICACY, COSMETIC ELEGANCE BUT INDUCES ONYL VERY LOW IRRITATION | JOHNSON & JOHNSON CONSUMER PRODUCTS, INC. (US) | 2000-05-30 | — | — | US | disclosed |
| WO-2000007993-A1 | SUBSTITUTED ISOQUINOLEINES AND THEIR USE AS ANTICONVULSIVANTS | SMITHKLINE BEECHAM PLC (GB) | 2000-02-17 | — | — | WO | disclosed |