Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21065984 | 0.86 | EPHX1 (0.50) | SLC6A2TAAR1SLC6A4MAOASLC6A3 | |
| SCHEMBL13733263 | 0.86 | EPHX1 (0.50) | SLC6A2TAAR1SLC6A4MAOASLC6A3 | |
| SCHEMBL15521920 | 0.86 | EPHX1 (0.50) | SLC6A2TAAR1SLC6A4MAOASLC6A3 | |
| SCHEMBL12525245 | 0.86 | EPHX1 (0.50) | SLC6A2TAAR1SLC6A4MAOASLC6A3 | |
| SCHEMBL13733261 | 0.86 | EPHX1 (0.50) | SLC6A2TAAR1SLC6A4MAOASLC6A3 | |
| SCHEMBL12524560 | 0.86 | EPHX1 (0.50) | SLC6A2TAAR1SLC6A4MAOASLC6A3 | |
| SCHEMBL12525249 | 0.79 | MAOB (0.48) | NPC1LMNAMAPTHTTRAB9A | |
| SCHEMBL7307677 | 0.76 | EPHX1 (0.61) | SLC6A2TAAR1SLC6A4MAOASLC6A3 | |
| SCHEMBL902538 | 0.76 | EPHX1 (0.61) | SLC6A2TAAR1SLC6A4MAOASLC6A3 | |
| SCHEMBL2736329 | 0.76 | EPHX1 (0.61) | SLC6A2TAAR1SLC6A4MAOASLC6A3 |
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-3501546-A2 | CYSTEINE DRUG CONJUGATES AND USE OF SAME | Seattle Genetics, Inc. (US) | 2019-06-26 | — | — | EP | disclosed |