Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.43 |
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29362162 | 0.82 | PTPN22 (0.65) | PTPN22POLBHSD17B10MAPTMEN1 | |
| SCHEMBL29027 | 0.82 | PTPN22 (0.65) | PTPN22POLBHSD17B10MAPTMEN1 | |
| SCHEMBL15400598 | 0.82 | PTPN22 (0.65) | PTPN22POLBHSD17B10MAPTMEN1 | |
| Hydrogen Sulfide SCHEMBL30378374 | 0.80 | PTPN22 (0.62) | PTPN22POLBHSD17B10MAPTMEN1 | |
| Charcoal, Activated SCHEMBL30539223 | 0.80 | PTPN22 (0.62) | PTPN22POLBHSD17B10MAPTMEN1 | |
| Methane SCHEMBL10406101 | 0.80 | PTPN22 (0.62) | PTPN22POLBHSD17B10MAPTMEN1 | |
| Water SCHEMBL18660620 | 0.80 | PTPN22 (0.62) | PTPN22POLBHSD17B10MAPTMEN1 | |
| SCHEMBL9875431 | 0.80 | PTPN22 (0.62) | PTPN22POLBHSD17B10MAPTMEN1 | |
| SCHEMBL16291794 | 0.80 | PTPN22 (0.62) | PTPN22POLBHSD17B10MAPTMEN1 | |
| SCHEMBL8381351 | 0.78 | PTPN22 (0.60) | PTPN22POLBHSD17B10MAPTMEN1 |
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-108658774-A | A kind of synthetic method of novel chiral nitro dinaphthol and its derivative | 中国科学院青岛生物能源与过程研究所 | 2018-10-16 | — | — | CN | disclosed |