Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCK | P35557 | 2/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.34 |
| ▸ | GPR39 | O43194 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.32 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.31 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24310582 | 0.89 | CYP1A2 (0.34) | CYP1A2CYP2C9CYP2C19TYRO3MAPK1 | |
| SCHEMBL24310334 | 0.89 | WNT1 (0.32) | GPR39CYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL24309828 | 0.88 | AXL (0.33) | TYRO3MEN1KMT2ATNK2AXL | |
| SCHEMBL24309634 | 0.84 | CACNA1B (0.33) | GPR39MAPTMEN1KMT2A | |
| SCHEMBL24309698 | 0.84 | CDK4 (0.37) | CCNA2CDK2 | |
| SCHEMBL24309693 | 0.84 | IRAK4 (0.33) | CHEK1 | |
| SCHEMBL24309680 | 0.84 | IRAK4 (0.33) | CHEK1 | |
| SCHEMBL24309688 | 0.83 | MAPK1 (0.46) | GPR39CYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL24309787 | 0.81 | MAPT (0.36) | GPR39CYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL29566649 | 0.80 | HTR1A (0.42) | CYP1A2MAPTCYP2C9CYP2C19HPGD |
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-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |