Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.47 |
| ▸ | KDM5A | P29375 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.45 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 5/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22533861 | 0.88 | FGFR1 (0.48) | TNFALDH1A1LMNAFGFR1PPARG | |
| SCHEMBL16713345 | 0.82 | PKM (0.54) | HPGDALDH1A1LMNAHCAR3FGFR1 | |
| SCHEMBL15105471 | 0.80 | HCAR3 (0.46) | HPGDALDH1A1LMNAHCAR3PPARG | |
| SCHEMBL22533814 | 0.79 | RXRA (0.42) | TNFHPGDALDH1A1LMNAHCAR3 | |
| SCHEMBL22533978 | 0.79 | BRD4 (0.48) | TNFALDH1A1LMNAFGFR1CYP11B1 | |
| SCHEMBL29424894 | 0.79 | BRD4 (0.48) | TNFALDH1A1LMNAFGFR1CYP11B1 | |
| SCHEMBL15076247 | 0.78 | PPARG (0.47) | HPGDALDH1A1LMNAHCAR3PPARG | |
| SCHEMBL2996553 | 0.76 | HCAR3 (0.60) | HPGDALDH1A1LMNAHCAR3FGFR1 | |
| SCHEMBL22533723 | 0.74 | TNF (0.48) | TNFHPGDFGFR1PPARGCYP11B1 | |
| SCHEMBL29424729 | 0.74 | TNF (0.48) | TNFHPGDFGFR1PPARGCYP11B1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3952995-A1 | BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS | Riboscience LLC (US) | 2022-02-16 | — | — | EP | disclosed |
| WO-2020210649-A1 | BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS | RIBOSCIENCE LLC (US) | 2020-10-15 | — | — | WO | disclosed |