Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSV | O60911 | 7/20 | 0.53 |
| ▸ | CTSL | P07711 | 7/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | STK10 | O94804 | 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 | |
|---|---|---|---|---|
| SCHEMBL4002579 | 0.83 | AR (0.51) | CTSVCTSLMEN1KMT2AMAPT | |
| SCHEMBL30578494 | 0.83 | AR (0.51) | CTSVCTSLMEN1KMT2AMAPT | |
| SCHEMBL10437485 | 0.78 | CTSV (0.60) | CTSVCTSLMEN1KMT2AMAPT | |
| SCHEMBL28476368 | 0.78 | PTK2 (0.48) | MEN1KMT2APIN1GAAMAPK1 | |
| SCHEMBL4002405 | 0.77 | L3MBTL1 (0.58) | MEN1KMT2AMAPTALDH1A1PIN1 | |
| SCHEMBL30578466 | 0.76 | GAA (0.63) | CTSVCTSLMAPTALDH1A1PIN1 | |
| SCHEMBL4716677 | 0.76 | GAA (0.63) | CTSVCTSLMAPTALDH1A1PIN1 | |
| SCHEMBL10437454 | 0.74 | CTSV (0.62) | CTSVCTSLMEN1KMT2AMAPT | |
| SCHEMBL5649981 | 0.73 | CTSV (0.60) | CTSVCTSLMEN1KMT2AMAPT | |
| SCHEMBL20581130 | 0.73 | MEN1 (0.48) | CTSVCTSLMEN1KMT2AMAPT |
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-111732584-B | Diaryl substituted fused heterocycle compound and preparation method and application thereof in pharmacy | 复旦大学 | 2024-02-27 | — | — | CN | disclosed |
| CN-111732584-A | Diaryl substituted fused heterocyclic compound, preparation method thereof and application thereof in pharmacy | 复旦大学 | 2020-10-02 | — | — | CN | disclosed |