Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28723925 | 1.00 | CA2 (0.57) | CA2GAARAB9AMTNR1AUSP2 | |
| SCHEMBL11221273 | 0.86 | CA2 (0.56) | CA2GAARAB9AMTNR1AALDH1A1 | |
| SCHEMBL28724511 | 0.85 | CA2 (0.56) | CA2MTNR1AALDH1A1FFAR1CYP1A2 | |
| SCHEMBL28724712 | 0.85 | DRD2 (0.56) | CA2GAARAB9AMTNR1AALDH1A1 | |
| SCHEMBL28724507 | 0.85 | CA2 (0.56) | CA2MTNR1AALDH1A1FFAR1CYP1A2 | |
| SCHEMBL28723917 | 0.85 | DRD2 (0.56) | CA2GAARAB9AMTNR1AALDH1A1 | |
| SCHEMBL9692477 | 0.84 | CYP1A2 (0.63) | GAARAB9AMTNR1AALDH1A1CYP1A2 | |
| SCHEMBL10916152 | 0.84 | MTNR1A (0.48) | CA2GAARAB9AMTNR1AALDH1A1 | |
| SCHEMBL28723946 | 0.81 | CA2 (0.55) | CA2GAARAB9AMTNR1AALDH1A1 | |
| SCHEMBL19776224 | 0.81 | CA2 (0.54) | CA2GAARAB9AMTNR1AFFAR1 |
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-109689664-B | Tricyclic heteroaryl substituted quinoline and azaquinoline compounds as PAR4 inhibitors | 百时美施贵宝公司 | 2022-04-15 | — | — | CN | disclosed |