Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | PTPN11 | Q06124 | 3/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.51 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5057431 | 0.98 | TSHR (0.58) | LTA4HTSHRPTPN11PTPN1SOAT1 | |
| Formic Acid SCHEMBL28457373 | 0.92 | PTPN11 (0.53) | LTA4HTSHRPTPN11PTPN1HDAC8 | |
| SCHEMBL17905718 | 0.88 | LTA4H (0.61) | LTA4HTSHRCYP1A2CYP19A1CYP2C9 | |
| SCHEMBL9583558 | 0.87 | TSHR (0.52) | LTA4HTSHRPTPN11CYP1A2CYP19A1 | |
| SCHEMBL9229928 | 0.86 | PTPN11 (0.74) | TSHRPTPN11PLA2G4B | |
| SCHEMBL3459345 | 0.86 | TSHR (0.55) | LTA4HTSHRPTPN11PTPN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL9222118 | 0.85 | PTPN11 (0.72) | TSHRPTPN11PLA2G4B | |
| SCHEMBL31550426 | 0.85 | LTA4H (0.66) | LTA4HTSHRPTPN11PTPN1CYP1A2 | |
| SCHEMBL17142884 | 0.84 | TSHR (0.69) | LTA4HTSHRPTPN11CYP1A2CYP19A1 | |
| SCHEMBL2151432 | 0.84 | TSHR (0.69) | LTA4HTSHRPTPN11CYP1A2CYP19A1 |
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-112300250-B | Anidulafungin analogue and preparation method thereof | 上海医药工业研究院 | 2024-03-19 | — | — | CN | disclosed |