Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.60 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.58 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.58 |
| ▸ | BLM | P54132 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL25090647 | 0.84 | KDM4E (0.62) | KDM4EALDH1A1HPGDTDP1ADORA2B | |
| SCHEMBL25090354 | 0.83 | KDM4E (0.72) | KDM4EALDH1A1HPGDTDP1ADORA2B | |
| SCHEMBL25090499 | 0.82 | KDM4E (0.55) | KDM4EALDH1A1HPGDTDP1ADORA2B | |
| SCHEMBL25090450 | 0.82 | ADORA2A (0.66) | KDM4EADORA2BCYP1A2HSD17B10ADORA3 | |
| SCHEMBL25090517 | 0.82 | KDM4E (0.60) | KDM4EALDH1A1HPGDTDP1ADORA2B | |
| SCHEMBL25089901 | 0.82 | ADORA2A (0.64) | KDM4EADORA2BCYP1A2HSD17B10ADORA3 | |
| SCHEMBL25090448 | 0.80 | ADORA2B (0.54) | KDM4EADORA2BCYP1A2HSD17B10ADORA3 | |
| SCHEMBL25090459 | 0.78 | ADORA2B (0.58) | KDM4EADORA2BCYP1A2HSD17B10ADORA3 | |
| SCHEMBL25090480 | 0.78 | ALDH1A1 (0.64) | KDM4EALDH1A1HPGDTDP1ADORA2B | |
| SCHEMBL25090491 | 0.77 | ADORA2B (0.75) | KDM4EALDH1A1HPGDADORA2BCYP1A2 |
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-2023023867-A1 | COMPOUNDS FOR REDUCING CHOLESTEROL AND TREATING LIVER AND KIDNEY DISEASE | MCMASTER UNIVERSITY (CA) | 2023-03-02 | — | — | WO | disclosed |