Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 10/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HCAR3 | P49019 | 6/20 | 0.45 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 5/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | RPA1 | P27694 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6110959 | 0.84 | ALPL (0.46) | ALPLTP53HCAR3HCAR2CA12 | |
| SCHEMBL31067527 | 0.84 | PLA2G10 (0.41) | ALPLTP53HCAR3 | |
| SCHEMBL16763221 | 0.83 | HCAR3 (0.50) | ALPLTP53HCAR3HCAR2CA12 | |
| SCHEMBL26054148 | 0.82 | TP53 (0.47) | ALPLTP53HCAR3HCAR2CA12 | |
| SCHEMBL6109448 | 0.81 | HCAR3 (0.45) | ALPLTP53HCAR3HCAR2CA12 | |
| SCHEMBL1431995 | 0.80 | ALPL (0.54) | ALPLTP53HCAR3HCAR2CA12 | |
| SCHEMBL31619084 | 0.80 | TP53 (0.46) | ALPLTP53HCAR3HCAR2CA12 | |
| SCHEMBL6110252 | 0.78 | HCAR3 (0.47) | ALPLTP53HCAR3HCAR2CA12 | |
| SCHEMBL31460191 | 0.78 | MAPK1 (0.59) | ALPLCA12CA9 | |
| SCHEMBL6111559 | 0.78 | HCAR3 (0.43) | ALPLTP53HCAR3HCAR2CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-5126446-A | Cyclization of 3-methyl-2-(4-chlorosulfinyl-2-oxo-3-amino-1-azetidinyl)-3-butenoic acid esters using lewis acid friedel-crafts catalyst, nitro compound, anhydrous conditions | ELI LILLY AND COMPANY (US) | 1992-06-30 | — | — | US | disclosed |