Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.50 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.50 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.50 |
| ▸ | DRD1 | P21728 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL13385106 | 0.83 | LMNA (0.68) | LMNACYP2D6MAOAPTGS1MTNR1A | |
| SCHEMBL2790730 | 0.81 | LMNA (0.55) | LMNACYP2D6MAOAPTGS1MTNR1A | |
| SCHEMBL15029217 | 0.79 | LMNA (0.53) | LMNACYP2D6MAOAPTGS1MTNR1A | |
| SCHEMBL6683927 | 0.79 | LMNA (0.53) | LMNACYP2D6MAOAPTGS1MTNR1A | |
| SCHEMBL13385060 | 0.79 | ALDH1A1 (0.57) | LMNAALDH1A1SMN1; SMN2TSHRCYP2D6 | |
| SCHEMBL6686112 | 0.78 | LMNA (0.52) | LMNAALDH1A1SMN1; SMN2CYP2D6ESR1 | |
| SCHEMBL2500159 | 0.78 | FFAR1 (0.61) | LMNACYP2D6MAOAPTGS1MTNR1A | |
| SCHEMBL3824504 | 0.77 | LMNA (0.46) | LMNAALDH1A1SMN1; SMN2TSHRCYP2D6 | |
| SCHEMBL10485538 | 0.77 | LMNA (0.55) | LMNAALDH1A1SMN1; SMN2TSHRCYP2D6 | |
| SCHEMBL28949610 | 0.77 | LTA4H (0.50) | LMNAALDH1A1SMN1; SMN2ESR1CHRM2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109574951-A | A kind of preparation method of Febuxostat | 安徽省庆云医药股份有限公司 | 2019-04-05 | — | — | CN | claimed |
| CN-109574951-A | A kind of preparation method of Febuxostat | 安徽省庆云医药股份有限公司 | 2019-04-05 | — | — | CN | disclosed |