Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 3/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 7/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | DGAT2 | Q96PD7 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | OGA | O60502 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25870419 | 0.77 | CYP3A4 (0.45) | CYP3A4MEN1KMT2AALDH1A1POLB | |
| SCHEMBL25876321 | 0.77 | CYP3A4 (0.43) | CYP3A4ACACBMEN1KMT2AALDH1A1 | |
| SCHEMBL25870687 | 0.75 | CYP3A4 (0.41) | CYP3A4ACACBMEN1KMT2AALDH1A1 | |
| SCHEMBL25876509 | 0.75 | PARP1 (0.45) | ITGB3ITGA2BCYP3A4MEN1KMT2A | |
| SCHEMBL25475904 | 0.69 | ACACB (0.44) | ACACBALDH1A1LMNA | |
| SCHEMBL25589849 | 0.66 | HRH4 (0.48) | MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL27425285 | 0.65 | PTPN11 (0.44) | ALDH1A1LMNAOGA | |
| SCHEMBL24590204 | 0.65 | POLB (0.49) | CYP3A4ACACBKMT2AALDH1A1LMNA | |
| SCHEMBL24126695 | 0.65 | OGA (0.51) | ACACBALDH1A1LMNAOGA | |
| SCHEMBL29218667 | 0.64 | KDM4E (0.44) | ACACBALDH1A1LMNAHPGD |
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 |