Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 3/20 | 0.50 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.43 |
| ▸ | CTSS | P25774 | 4/20 | 0.38 |
| ▸ | CTSK | P43235 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | AXL | P30530 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL11607608 | 0.93 | P2RX7 (0.41) | P2RX7NOTUMCTSSCA2KDM4E | |
| SCHEMBL1043059 | 0.90 | P2RX7 (0.57) | P2RX7NOTUMCTSSCTSKCA2 | |
| SCHEMBL11608874 | 0.86 | P2RX7 (0.37) | P2RX7NOTUM | |
| SCHEMBL11597821 | 0.86 | P2RX7 (0.37) | P2RX7NOTUMPDK2TDP1 | |
| SCHEMBL11599177 | 0.86 | P2RX7 (0.50) | P2RX7NOTUMCTSSCTSKCA2 | |
| SCHEMBL10893212 | 0.86 | P2RX7 (0.50) | P2RX7NOTUMCTSSCTSKCA2 | |
| SCHEMBL8665946 | 0.81 | TSHR (0.41) | P2RX7NOTUMPDK2ALDH1A1TDP1 | |
| SCHEMBL802989 | 0.79 | P2RX7 (0.53) | P2RX7NOTUMCTSSCTSKCA2 | |
| SCHEMBL29764291 | 0.78 | P2RX7 (0.52) | P2RX7NOTUMCTSSCTSKKDM4E | |
| SCHEMBL312929 | 0.78 | P2RX7 (0.52) | P2RX7NOTUMCTSSCTSKKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4079089-A | CONTACTING A BIS/TRICHLOROMETHYL/-BENZENE WITH HYDROGEN FLUORIDE, HALOGEN TRANSFER CATALYST | BAYER AKTIENGESELLSCHAFT (DT) | 1978-03-14 | — | — | US | disclosed |