Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL15723552 | 0.81 | MAPK1 (0.58) | MAPK1CYP1A2CYP2D6CYP2C19SYK | |
| SCHEMBL23018998 | 0.80 | TP53 (0.53) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL7007855 | 0.77 | ACHE (0.50) | ALDH1A1LMNA | |
| SCHEMBL21633896 | 0.77 | CHRNB2 (0.64) | MAPK1CYP1A2CYP2D6CYP2C19CHRNB2 | |
| SCHEMBL30527592 | 0.77 | CHRNB2 (0.64) | MAPK1CYP1A2CYP2D6CYP2C19CHRNB2 | |
| SCHEMBL10186609 | 0.76 | MAPK1 (0.68) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL16668774 | 0.76 | TSHR (0.55) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL25981244 | 0.76 | MAPK1 (0.53) | MAPK1CYP1A2CYP2D6CYP2C19SYK | |
| SCHEMBL4568919 | 0.74 | MAPK1 (0.56) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL12126283 | 0.74 | MAPK1 (0.70) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 |
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-2016046225-A1 | NOVEL COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2016-03-31 | — | — | WO | disclosed |