Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | HTR1B | P28222 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL311482 | 0.91 | HTR1B (0.51) | KDM4EHTR1BTSHRCYP3A4PIK3CA | |
| SCHEMBL21694203 | 0.85 | CYP1A2 (0.61) | KDM4EHTR1BTSHRCYP3A4PIK3CA | |
| SCHEMBL1141672 | 0.85 | CYP1A2 (0.56) | KDM4EHTR1BTSHRCYP3A4PIK3CA | |
| SCHEMBL21694213 | 0.83 | CYP1A2 (0.65) | KDM4EHTR1BTSHRCYP3A4PIK3CA | |
| SCHEMBL21694153 | 0.83 | CYP1A2 (0.65) | KDM4EHTR1BTSHRCYP3A4PIK3CA | |
| SCHEMBL10264421 | 0.83 | CYP1A2 (0.70) | KDM4EHTR1BTSHRCYP3A4PIK3CA | |
| SCHEMBL8489747 | 0.83 | TSHR (0.46) | KDM4EHTR1BTSHRCYP3A4PIK3CA | |
| SCHEMBL10635778 | 0.83 | TSHR (0.46) | KDM4EHTR1BTSHRCYP3A4PIK3CA | |
| SCHEMBL7415579 | 0.82 | HTR1B (0.62) | KDM4EHTR1BTSHRMAPK1TP53 | |
| SCHEMBL23493017 | 0.81 | CYP1A2 (0.62) | KDM4EHTR1BTSHRCYP3A4PIK3CA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109563073-A | For the treatment of para-5-HT1AReceptor-controlled serotonergic disease-modulating compounds | 诺罗利西斯公司 | 2019-04-02 | — | — | CN | disclosed |