Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.69 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.59 |
| ▸ | BRD4 | O60885 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL13659581 | 0.88 | TP53 (0.62) | TSHRMAPTKMT2AMEN1NPSR1 | |
| SCHEMBL9722109 | 0.79 | ALDH1A1 (0.72) | ANO1MAPTL3MBTL1KMT2AMEN1 | |
| SCHEMBL10344531 | 0.78 | MEN1 (0.65) | TSHRANO1MAPTL3MBTL1KMT2A | |
| SCHEMBL10857636 | 0.77 | NOTUM (0.70) | ANO1MAPTL3MBTL1KMT2AMEN1 | |
| SCHEMBL11475652 | 0.77 | SMN1; SMN2 (0.69) | TSHRANO1MAPTL3MBTL1KMT2A | |
| SCHEMBL12259122 | 0.77 | L3MBTL1 (0.64) | TSHRANO1MAPTL3MBTL1KMT2A | |
| SCHEMBL24195608 | 0.76 | ANO1 (0.66) | TSHRANO1BRD4MAPTL3MBTL1 | |
| SCHEMBL6907487 | 0.75 | L3MBTL1 (0.76) | TSHRANO1MAPTL3MBTL1KMT2A | |
| SCHEMBL24349097 | 0.74 | ANO1 (1.00) | TSHRANO1MAPTL3MBTL1KMT2A | |
| SCHEMBL11872902 | 0.74 | MEN1 (0.68) | TSHRMAPTKMT2AMEN1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009128964-A2 | ENSEMBLE-BASED VIRTUAL SCREENING REVEALS NOVEL ANTIVIRAL COMPOUNDS FOR AVIAN INFLUENZA NEURAMINIDASE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2009-10-22 | — | — | WO | disclosed |