Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 13/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 12/20 | 0.42 |
| ▸ | FPR3 | P25089 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | ESRRB | O95718 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESRRA | P11474 | 1/20 | 0.36 |
| ▸ | ESRRG | P62508 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL29104012 | 0.83 | NR1H2 (0.45) | NR1H2NR1H3FPR3FPR2ESRRB | |
| SCHEMBL29104046 | 0.82 | NR1H2 (0.48) | NR1H2NR1H3FPR3FPR2ESRRB | |
| SCHEMBL25808763 | 0.78 | NR1H2 (0.51) | NR1H2NR1H3ESRRBESR1ESRRA | |
| SCHEMBL29104051 | 0.78 | NR1H2 (0.51) | NR1H2NR1H3ESRRBESR1ESRRA | |
| SCHEMBL29104020 | 0.78 | NR1H2 (0.51) | NR1H2NR1H3ESRRBESR1ESRRA | |
| SCHEMBL29104088 | 0.78 | NR1H2 (0.51) | NR1H2NR1H3ESRRBESR1ESRRA | |
| SCHEMBL29104028 | 0.75 | NR1H2 (0.44) | NR1H2NR1H3FPR3FPR2ESRRB | |
| SCHEMBL18377007 | 0.73 | NR1H2 (0.53) | NR1H2NR1H3ESRRBESR1ESRRA | |
| SCHEMBL31111659 | 0.73 | NR1H2 (0.53) | NR1H2NR1H3ESRRBESR1ESRRA | |
| SCHEMBL29104026 | 0.72 | NR1H2 (0.51) | NR1H2NR1H3ESRRBESR1ESRRA |
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-117003755-A | Pyrazolopyridazinone derivatives, compositions and uses thereof | 北京伯汇生物技术有限公司 | 2023-11-07 | — | — | CN | disclosed |