Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 4/20 | 0.60 |
| ▸ | HTR2B | P41595 | 4/20 | 0.60 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.41 |
| ▸ | ITGAV | P06756 | 2/20 | 0.41 |
| ▸ | ITGB6 | P18564 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A12 | P48065 | 2/20 | 0.35 |
| ▸ | SLC6A11 | P48066 | 2/20 | 0.35 |
| ▸ | SLC6A13 | Q9NSD5 | 2/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6326980 | 0.81 | ITGB3 (0.43) | HTR2CHTR2BITGB3ITGAVITGB6 | |
| SCHEMBL23993632 | 0.77 | HTR2C (0.68) | HTR2CHTR2BHTR2ASLC6A4KDM1A | |
| SCHEMBL6320155 | 0.77 | ITGB3 (0.49) | HTR2CHTR2BITGB3ITGAVITGB6 | |
| SCHEMBL2432912 | 0.73 | FFAR1 (0.53) | HTR2CHTR2BPPARDHTR2A | |
| SCHEMBL14527911 | 0.70 | PTGDR2 (0.57) | HTR2CHTR2BHTR2A | |
| SCHEMBL14774665 | 0.69 | KDM1A (0.70) | HTR2CHTR2BKDM1AKDM1B | |
| SCHEMBL6327011 | 0.68 | HTR2A (0.45) | HTR2CHTR2BITGB3ITGAVITGB6 | |
| SCHEMBL27270387 | 0.67 | SLC6A12 (0.39) | HTR2CHTR2BITGB3ITGAVITGB6 | |
| SCHEMBL27404051 | 0.67 | HTR2C (0.40) | HTR2CHTR2BITGB3ITGAVITGB6 | |
| SCHEMBL12035570 | 0.67 | ITGB3 (0.39) | HTR2CHTR2BITGB3ITGAVITGB6 |
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-2024130064-A1 | SUBSTITUTED TETRAHYDROPYRROLO-PYRIDINONE COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS | Karuna Therapeutics, Inc. (US) | 2024-06-20 | — | — | WO | disclosed |