Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 8/20 | 0.81 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2065837 | 0.90 | MAPT (1.00) | MAPTHTTGAACYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL15329323 | 0.87 | MAPT (0.94) | MAPTHTTGAACYP1A2CYP3A4 | |
| SCHEMBL11520411 | 0.83 | MAPT (0.85) | MAPTHTTGAACYP1A2CYP3A4 | |
| SCHEMBL11521297 | 0.83 | MAPT (0.85) | MAPTHTTGAACYP1A2CYP3A4 | |
| SCHEMBL11530504 | 0.81 | MAPT (0.81) | MAPTHTTGAACYP1A2CYP3A4 | |
| SCHEMBL11518048 | 0.80 | MAPT (0.80) | MAPTHTTGAAHRH3MEN1 | |
| SCHEMBL7735621 | 0.79 | MAPT (0.70) | MAPTHTTGAAMEN1KMT2A | |
| SCHEMBL25688194 | 0.79 | TAAR1 (0.54) | MAPTGAACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL22542435 | 0.79 | TMEM97 (0.54) | MAPTGAACYP3A4CYP2C9MEN1 | |
| SCHEMBL11526668 | 0.79 | MAPT (0.77) | MAPTHTTGAACYP1A2CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020210377-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | NUVATION BIO INC. (US) | 2020-10-15 | — | — | WO | disclosed |
| WO-2020210383-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | NUVATION BIO INC. (US) | 2020-10-15 | — | — | WO | disclosed |
| WO-2017197488-A1 | LIBRARIES OF DIVERSE MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | CYCLENIUM PHARMA INC. (CA) | 2017-11-23 | — | — | WO | disclosed |
| EP-2691095-B1 | IMIDAZOLYL AMIDE COMPOUNDS AND USES RELATED THERETO | UNIV EMORY (US) | 2017-07-05 | — | — | EP | disclosed |