Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 14/20 | 0.69 |
| ▸ | DYRK1A | Q13627 | 7/20 | 0.69 |
| ▸ | ACHE | P22303 | 2/20 | 0.69 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.69 |
| ▸ | CDK1 | P06493 | 2/20 | 0.69 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.69 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.69 |
| ▸ | CDK2 | P24941 | 2/20 | 0.69 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.69 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.69 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.69 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.69 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.69 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.69 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL18212310 | 0.86 | MAOA (0.64) | MAOADYRK1AACHECCNB2CDK1 | |
| SCHEMBL16892263 | 0.86 | MAOA (0.64) | MAOADYRK1AACHECCNB2CDK1 | |
| SCHEMBL16892224 | 0.86 | MAOA (0.61) | MAOADYRK1AACHECCNB2CDK1 | |
| SCHEMBL12071304 | 0.84 | MAOA (0.63) | MAOADYRK1AACHECCNB2CDK1 | |
| SCHEMBL17102947 | 0.84 | MAOA (0.72) | MAOADYRK1AACHECCNB2CDK1 | |
| SCHEMBL20726348 | 0.82 | DYRK1A (0.65) | MAOADYRK1AACHECCNB2CDK1 | |
| SCHEMBL21393272 | 0.82 | MAOA (0.70) | MAOADYRK1AACHECCNB2CDK1 | |
| Harmine SCHEMBL9481427 | 0.82 | MAOA (1.00) | MAOADYRK1AACHECCNB2CDK1 | |
| Harmine SCHEMBL292955 | 0.82 | MAOA (1.00) | MAOADYRK1AACHECCNB2CDK1 | |
| Harmine SCHEMBL29440552 | 0.82 | MAOA (1.00) | MAOADYRK1AACHECCNB2CDK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20100028469-A1 | Extracts of Cranberry and Methods of Using Thereof | HERBALSCIENCE GROUP, LLC (US) | 2010-02-04 | — | — | US | disclosed |
| US-7348336-B2 | Substituted β-carbolines | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2008-03-25 | — | — | US | disclosed |
| US-7348336-B2 | Substituted β-carbolines | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2008-03-25 | — | — | US | disclosed |