Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | DRD1 | P21728 | 2/20 | 0.31 |
| ▸ | DRD4 | P21917 | 2/20 | 0.31 |
| ▸ | DRD5 | P21918 | 2/20 | 0.31 |
| ▸ | DRD3 | P35462 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28070748 | 0.87 | KDM4E (0.32) | ALDH1A1THRBMEN1MAPTKMT2A | |
| Trimethylammonium SCHEMBL28070834 | 0.83 | — | — | |
| SCHEMBL3671745 | 0.83 | CA1 (0.32) | — | |
| SCHEMBL29396896 | 0.83 | CA1 (0.32) | — | |
| Benzene SCHEMBL29853972 | 0.79 | CA1 (0.30) | — | |
| SCHEMBL28070747 | 0.78 | — | — | |
| SCHEMBL8754774 | 0.73 | THRA (0.33) | NPSR1LMNATHRBCYP2D6CYP1A2 | |
| SCHEMBL8756387 | 0.73 | THRA (0.33) | NPSR1LMNATHRBCYP2D6CYP1A2 | |
| SCHEMBL4858235 | 0.71 | CA1 (0.34) | MAPT | |
| SCHEMBL7627034 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103857706-B | Kinetic Modulation of Metallocene Catalysts | 埃克森美孚化学专利公司 | 2016-09-28 | — | — | CN | claimed |
| CN-103857706-B | Kinetic Modulation of Metallocene Catalysts | 埃克森美孚化学专利公司 | 2016-09-28 | — | — | CN | disclosed |