Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN5 | P54829 | 1/20 | 0.50 |
| ▸ | MPO | P05164 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.44 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TAS2R14 | Q9NYV8 | 3/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23326510 | 1.00 | PTPN5 (0.50) | PTPN5MPOCYP2C19CYP1A2CYP2C9 | |
| SCHEMBL23326539 | 0.89 | PTPN5 (0.51) | PTPN5MPOCYP2C19CYP1A2CYP2C9 | |
| SCHEMBL23326784 | 0.80 | PTPN5 (0.44) | PTPN5MPOCYP2C19CYP1A2CYP2C9 | |
| SCHEMBL29861148 | 0.80 | PTPN5 (0.44) | PTPN5MPOCYP2C19CYP1A2CYP2C9 | |
| SCHEMBL3885198 | 0.79 | KDM4E (0.59) | MPOCYP2C19CYP1A2CYP2C9AKR1C3 | |
| SCHEMBL11323055 | 0.79 | GRIK1 (0.62) | MPOCYP2C19CYP1A2CYP2C9KDM4E | |
| SCHEMBL23345280 | 0.77 | PTPN5 (0.49) | PTPN5CYP2C19CYP1A2CYP2C9GPR35 | |
| SCHEMBL9465049 | 0.75 | TAS2R14 (0.43) | MPOCYP2C19AKR1C3AKR1C2GPR35 | |
| SCHEMBL31697325 | 0.75 | TAS2R14 (0.43) | MPOCYP2C19AKR1C3AKR1C2GPR35 | |
| SCHEMBL9465832 | 0.74 | ALDH1A1 (0.46) | MPOCYP2C19CYP1A2AKR1C3AKR1C2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116425742-A | Bicyclic heteroaryl compounds and uses thereof | 锐新医药公司 | 2023-07-14 | — | — | CN | disclosed |
| EP-4055017-A1 | BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF | Revolution Medicines, Inc. (US) | 2022-09-14 | — | — | EP | disclosed |
| CN-114901662-A | Bicyclic heteroaryl compounds and uses thereof | 锐新医药公司 | 2022-08-12 | — | — | CN | disclosed |