Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAD51 | Q06609 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA4 | P22748 | 2/20 | 0.31 |
| ▸ | CA6 | P23280 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.30 |
| ▸ | CTSB | P07858 | 1/20 | 0.30 |
| ▸ | CTSS | P25774 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25520210 | 1.00 | RAD51 (0.35) | RAD51TSHRMAPK1HTTMAPT | |
| SCHEMBL25519896 | 0.93 | CA12 (0.34) | RAD51TSHRMAPK1HTTMAPT | |
| SCHEMBL29973748 | 0.93 | CA12 (0.34) | RAD51TSHRMAPK1HTTMAPT | |
| SCHEMBL29973654 | 0.83 | PIK3CA (0.35) | — | |
| SCHEMBL25520188 | 0.83 | PIK3CA (0.35) | — | |
| SCHEMBL28913228 | 0.82 | TSHR (0.33) | RAD51TSHRMAPK1HTTCTSL | |
| SCHEMBL30171238 | 0.79 | HTR6 (0.35) | TSHRMAPK1HTTMAPTCA1 | |
| SCHEMBL25519678 | 0.79 | L3MBTL1 (0.39) | TSHRMAPK1HTTMAPT | |
| SCHEMBL28948193 | 0.73 | ALDH1A1 (0.43) | MAPK1HTTCA1CA2CA4 | |
| SCHEMBL11970766 | 0.73 | CA1 (0.54) | MAPTCA1CA2CA4CA6 |
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-115677684-A | Substituted aryl or heteroaryl compounds | 先声药业有限公司 | 2023-02-03 | — | — | CN | disclosed |
| CN-115315423-A | Substituted aryl compounds | 先声药业有限公司 | 2022-11-08 | — | — | CN | disclosed |