Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.46 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
| ▸ | RXRG | P48443 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 3/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.42 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.42 |
| ▸ | CSF1R | P07333 | 2/20 | 0.40 |
| ▸ | CHKA | P35790 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | KIT | P10721 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30502771 | 1.00 | EGFR (0.46) | EGFRGRM4GRM5ALDH1A1HTR3E | |
| SCHEMBL25453062 | 0.83 | KCNH2 (0.47) | EGFRGRM5RXRAKDRCSF1R | |
| SCHEMBL25453079 | 0.82 | EGFR (0.48) | EGFRALDH1A1RXRARXRBRXRG | |
| SCHEMBL25175471 | 0.82 | ALDH1A1 (0.47) | EGFRGRM5ALDH1A1KDR | |
| SCHEMBL26186425 | 0.79 | P2RX4 (0.40) | GRM4GRM5ALDH1A1HTR3EHTR3B | |
| SCHEMBL4667357 | 0.77 | ALDH1A1 (0.43) | EGFRALDH1A1KDR | |
| SCHEMBL4431783 | 0.77 | KDR (0.50) | EGFRGRM4GRM5HTR3EHTR3B | |
| SCHEMBL25453064 | 0.73 | GRIA1 (0.37) | EGFRGRM5ALDH1A1 | |
| SCHEMBL7236726 | 0.73 | CYP2D6 (0.41) | EGFRALDH1A1KDRFGFR1 | |
| SCHEMBL2723906 | 0.71 | PDPK1 (0.43) | EGFRGRM4HTR3EHTR3BHTR3A |
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-2023081800-A1 | ALPHA-2A ADRENERGIC RECEPTOR MODULATORS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2023-05-11 | — | — | WO | disclosed |