Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 3/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | ACKR3 | P25106 | 6/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1017905 | 0.86 | CHRM3 (0.61) | CHRM3 | |
| Hydrochloric Acid SCHEMBL1018725 | 0.85 | CHRM3 (0.60) | CHRM3 | |
| SCHEMBL28052543 | 0.83 | HDAC1 (0.45) | CHRM3HDAC1ACKR3CYP2D6CYP2C9 | |
| SCHEMBL1020776 | 0.83 | CYP2D6 (0.52) | HDAC1ACKR3CYP2D6CYP2C9HIF1A | |
| SCHEMBL1022120 | 0.83 | GLS (0.49) | CHRM3HDAC1ACKR3ALDH1A1LMNA | |
| SCHEMBL12955045 | 0.82 | CHRM3 (0.57) | CHRM3CYP2D6CYP2C9HIF1ATDP1 | |
| SCHEMBL13701762 | 0.82 | MAPT (0.49) | CHRM3ALDH1A1LMNATDP1MAPT | |
| SCHEMBL1017900 | 0.82 | MEN1 (0.53) | CHRM3ALDH1A1LMNAKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL1019737 | 0.81 | CHRM3 (0.56) | CHRM3CYP2D6CYP2C9HIF1A | |
| SCHEMBL21319459 | 0.81 | CYP2D6 (0.73) | CYP2D6CYP2C9HIF1AALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-8110687-B2 | Bicyclic compounds with kinase inhibitory activity | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2012-02-07 | — | — | US | disclosed |