Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | MMP3 | P08254 | 1/20 | 0.48 |
| ▸ | MMP7 | P09237 | 1/20 | 0.48 |
| ▸ | MMP13 | P45452 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3129065 | 0.80 | SLC6A2 (0.53) | ROCK2THRBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL21660196 | 0.80 | THRB (0.48) | ROCK2THRBTP53KMT2AMEN1 | |
| SCHEMBL5476061 | 0.79 | KMT2A (0.48) | ROCK2THRBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5476062 | 0.79 | KMT2A (0.48) | ROCK2THRBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5476066 | 0.79 | KMT2A (0.48) | ROCK2THRBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9416588 | 0.79 | HSD17B2 (0.57) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL12745020 | 0.79 | ROCK2 (0.49) | ROCK2THRBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL12004668 | 0.79 | THRB (0.55) | ROCK2THRBTP53KMT2APOLB | |
| SCHEMBL12496027 | 0.79 | HSD17B2 (0.53) | ROCK2THRBTP53KMT2AROCK1 | |
| SCHEMBL6417242 | 0.78 | HSD17B2 (0.63) | ROCK2KMT2AMEN1ROCK1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1554239-A2 | SULFONYLAMINO-ACETIC ACID DERIVATIVES AND THEIR USE AS OREXIN RECEPTOR ANTAGONISTS | Actelion Pharmaceuticals Ltd. (CH) | 2005-07-20 | — | — | EP | disclosed |
| WO-2004033418-A2 | SULFONYLAMINO-ACETIC DERIVATIVES AND THEIR USE AS OREXIN RECEPTOR ANTAGONISTS | ACTELION PHARMACEUTICALS LTD. (CH) | 2004-04-22 | — | — | WO | disclosed |