Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL29601933 | 0.81 | P2RX7 (0.56) | CA1CA2CA9P2RX7LMNA | |
| SCHEMBL29601285 | 0.77 | ALDH1A1 (0.43) | P2RX7SMN1; SMN2ALDH1A1POLBTDP1 | |
| SCHEMBL29601397 | 0.76 | P2RX7 (0.35) | P2RX7 | |
| SCHEMBL3425599 | 0.73 | ADORA2A (0.39) | BCHEPIN1SMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL30496453 | 0.73 | ADORA2A (0.39) | BCHEPIN1SMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL183167 | 0.72 | YTHDC1 (0.47) | SMN1; SMN2ALDH1A1GAAKMT2APKM | |
| SCHEMBL29601245 | 0.72 | YTHDC1 (0.47) | SMN1; SMN2ALDH1A1GAAKMT2APKM | |
| SCHEMBL29601170 | 0.69 | ALDH1A1 (0.35) | P2RX7ALDH1A1 | |
| SCHEMBL29601682 | 0.67 | ALDH3A1 (0.47) | P2RX7ALDH1A1PKM | |
| SCHEMBL29601293 | 0.67 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1KMT2AMEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3997089-A1 | CYSTEINE BINDING COMPOSITIONS AND METHODS OF USE THEREOF | University Of Virginia Patent Foundation (US) | 2022-05-18 | — | — | EP | claimed |