Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.33 |
| ▸ | ACACB | O00763 | 2/20 | 0.33 |
| ▸ | TIPARP | Q7Z3E1 | 4/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.30 |
| ▸ | OGA | O60502 | 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 | |
|---|---|---|---|---|
| SCHEMBL24639836 | 0.88 | HRH3 (0.35) | HRH3NR1H2NR1H3ACACBTIPARP | |
| SCHEMBL24639834 | 0.88 | CHRM2 (0.34) | HRH3NR1H2NR1H3ACACBTIPARP | |
| SCHEMBL24639861 | 0.82 | HRH3 (0.36) | HRH3NR1H2NR1H3ACACBTIPARP | |
| SCHEMBL24639851 | 0.82 | HRH3 (0.36) | HRH3NR1H2NR1H3ACACBTIPARP | |
| SCHEMBL24639871 | 0.80 | HRH3 (0.37) | HRH3NR1H2NR1H3ACACBTIPARP | |
| SCHEMBL24639833 | 0.79 | NR1H2 (0.37) | HRH3NR1H2NR1H3ACACBTIPARP | |
| SCHEMBL31245432 | 0.79 | HTR2C (0.36) | HTR2BSCN10APOLB | |
| SCHEMBL24639855 | 0.78 | ACACB (0.40) | HRH3NR1H2NR1H3ACACBTIPARP | |
| SCHEMBL24640155 | 0.77 | CHRM2 (0.37) | HRH3NR1H2NR1H3ACACBTIPARP | |
| SCHEMBL26958078 | 0.77 | CHRM2 (0.37) | HRH3NR1H2NR1H3ACACBTIPARP |
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-2022170974-A1 | TRICYCLIC DERIVATIVES USEFUL AS PARP7 INHIBITORS | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2022-08-18 | — | — | WO | disclosed |