Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CDC25B | P30305 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL30294656 | 1.00 | MRGPRX4 (0.42) | MRGPRX4CYP1A2CYP2C9CYP2C19THRB | |
| SCHEMBL30294715 | 0.93 | KDM4E (0.42) | MRGPRX4CYP1A2CYP2C9CYP2C19THRB | |
| SCHEMBL22853359 | 0.93 | KDM4E (0.42) | MRGPRX4CYP1A2CYP2C9CYP2C19THRB | |
| SCHEMBL22853414 | 0.86 | MRGPRX4 (0.45) | MRGPRX4CYP1A2CYP2C9CYP2C19THRB | |
| SCHEMBL30294513 | 0.86 | MRGPRX4 (0.45) | MRGPRX4CYP1A2CYP2C9CYP2C19THRB | |
| SCHEMBL22852871 | 0.84 | MPO (0.57) | MPOTAS2R14 | |
| SCHEMBL30294370 | 0.84 | MPO (0.57) | MPOTAS2R14 | |
| SCHEMBL22853040 | 0.83 | CDC25B (0.48) | MRGPRX4CYP1A2CYP2C9CYP2C19THRB | |
| SCHEMBL30294858 | 0.83 | CDC25B (0.48) | MRGPRX4CYP1A2CYP2C9CYP2C19THRB | |
| SCHEMBL22853045 | 0.81 | MAP2K2 (0.43) | CYP1A2CYP2C9CYP2C19KDM4ELMNA |
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-2020261114-A1 | 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2020-12-30 | — | — | WO | disclosed |