Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.44 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.44 |
| ▸ | LCK | P06239 | 2/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | PTPRO | Q16827 | 1/20 | 0.44 |
| ▸ | STAT3 | P40763 | 2/20 | 0.43 |
| ▸ | HNF4A | P41235 | 1/20 | 0.43 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.41 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.41 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.41 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2781616 | 0.88 | LMNA (0.42) | KAT8MCL1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL2779102 | 0.83 | MRGPRX4 (0.47) | CYP1A2CYP2D6CYP2C19MEN1KMT2A | |
| SCHEMBL2781727 | 0.83 | RARB (0.45) | CYP1A2CYP2D6MEN1KMT2AL3MBTL1 | |
| SCHEMBL2781686 | 0.81 | CYP1A2 (0.48) | CYP1A2CYP2D6CYP2C19MEN1KMT2A | |
| SCHEMBL2784683 | 0.81 | FFAR1 (0.47) | CYP1A2CYP2D6CYP2C19MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL2779523 | 0.80 | SLC16A3 (0.49) | MCL1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| SCHEMBL2782718 | 0.77 | CYP1A2 (0.47) | CYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL2780500 | 0.76 | KDM4E (0.44) | CYP1A2CYP2D6CYP2C19PPARABCL2L1 | |
| SCHEMBL2783032 | 0.74 | CXCR2 (0.47) | CYP1A2CYP2D6EGFRMEN1KMT2A | |
| SCHEMBL2778659 | 0.72 | ALDH1A1 (0.41) | CYP2C19MEN1KMT2AL3MBTL1KDM4E |
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-2010136036-A2 | CALCIUM-SENSING RECEPTOR-ACTIVE COMPOUNDS | LEO PHARMA A/S (DK) | 2010-12-02 | — | — | WO | disclosed |