Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.41 |
| ▸ | PLA2G10 | O15496 | 2/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.36 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL23212136 | 0.70 | BCAT2 (0.49) | PARP1PARP2PARP3 | |
| SCHEMBL45808 | 0.70 | L3MBTL1 (0.41) | PARP1PLA2G2APLA2G10CDC7LIMK1 | |
| SCHEMBL27866307 | 0.70 | PLA2G2A (0.46) | PARP1PLA2G2APLA2G10ADRA1DCDC7 | |
| SCHEMBL30739079 | 0.70 | PARP1 (0.52) | PARP1ADRA1DL3MBTL1 | |
| SCHEMBL26116843 | 0.68 | NNMT (0.35) | PARP1PARP2PARP3L3MBTL1 | |
| SCHEMBL2306128 | 0.68 | SYK (0.48) | PARP1PLA2G2APLA2G10CDC7CYP2C9 | |
| SCHEMBL17868978 | 0.68 | TSHR (0.43) | TSHRBRD4CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL23212135 | 0.68 | PARP1 (0.56) | PARP1L3MBTL1 | |
| SCHEMBL29678064 | 0.67 | ADRA1D (0.50) | PARP1ADRA1D | |
| SCHEMBL22717306 | 0.66 | PLA2G2A (0.45) | PLA2G2APLA2G10ADRA1DCDC7L3MBTL1 |
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-2021068179-A1 | NOVEL HETEROARYL-SUBSTITUTED PYRAZINE DERIVATIVES AS PESTICIDES | BAYER ANIMAL HEALTH GMBH (DE) | 2021-04-15 | — | — | WO | disclosed |