Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KDM4A | O75164 | 1/20 | 0.30 |
| ▸ | KDM4B | O94953 | 1/20 | 0.30 |
| ▸ | KDM5C | P41229 | 1/20 | 0.30 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20574714 | 1.00 | HCRTR1 (0.33) | HCRTR1HCRTR2KDM4EALDH1A1KDM4A | |
| SCHEMBL24135266 | 0.88 | HCRTR1 (0.33) | HCRTR1HCRTR2 | |
| SCHEMBL30751815 | 0.72 | KCNJ1 (0.41) | KDM4EALDH1A1 | |
| SCHEMBL20168329 | 0.72 | KCNJ1 (0.41) | KDM4EALDH1A1 | |
| SCHEMBL30444569 | 0.72 | KCNJ1 (0.42) | — | |
| SCHEMBL30751811 | 0.72 | KCNJ1 (0.42) | — | |
| SCHEMBL26536084 | 0.72 | KCNJ1 (0.33) | KDM4E | |
| SCHEMBL20574979 | 0.72 | KCNJ1 (0.42) | — | |
| SCHEMBL20168622 | 0.72 | KCNJ1 (0.42) | — | |
| SCHEMBL20168439 | 0.72 | KCNJ1 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110678463-B | Substituted nitrogen-containing compounds | 百时美施贵宝公司 | 2023-06-06 | — | — | CN | disclosed |