Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25870433 | 0.80 | ALDH1A1 (0.48) | MEN1KMT2ASMN1; SMN2ITGB3ITGA2B | |
| SCHEMBL25876613 | 0.78 | ALDH1A1 (0.49) | MEN1KMT2ASMN1; SMN2ITGB3ITGA2B | |
| SCHEMBL24411744 | 0.78 | SMN1; SMN2 (0.47) | MEN1KMT2ASMN1; SMN2ITGB3ITGA2B | |
| SCHEMBL25870426 | 0.76 | CYP2D6 (0.39) | TSHRCYP1A2CYP2C9ALDH1A1CYP2D6 | |
| SCHEMBL25870576 | 0.74 | CYP2D6 (0.48) | MEN1KMT2ASMN1; SMN2ITGB3ITGA2B | |
| SCHEMBL25870685 | 0.74 | HIF1A (0.39) | MEN1KMT2ASMN1; SMN2ITGB3ITGA2B | |
| SCHEMBL12308626 | 0.73 | CYP1A2 (0.37) | TSHRCYP1A2CYP2C9ALDH1A1CYP2D6 | |
| SCHEMBL25870699 | 0.72 | SMN1; SMN2 (0.47) | MEN1KMT2ASMN1; SMN2ITGB3ITGA2B | |
| SCHEMBL25870429 | 0.72 | ITGB3 (0.39) | MEN1KMT2ASMN1; SMN2ITGB3ITGA2B | |
| SCHEMBL12308617 | 0.72 | RIPK1 (0.36) | MEN1KMT2ASMN1; SMN2CYP1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023116920-A1 | PENTA- FUSED HEXA-HETEROCYCLIC COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE | 杭州多域生物技术有限公司 | 2023-06-29 | — | — | WO | disclosed |