Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 3/20 | 0.40 |
| ▸ | LTA4H | P09960 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | TXNRD1 | Q16881 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5293941 | 0.90 | TXNRD1 (0.43) | KMT2AMEN1RXFP1CYP3A4CYP2D6 | |
| SCHEMBL5290581 | 0.88 | PLCG1 (0.47) | KMT2AMEN1RXFP1CYP3A4CYP2D6 | |
| SCHEMBL5297846 | 0.87 | AR (0.45) | KMT2AMEN1RXFP1FAAHMGLL | |
| SCHEMBL5298909 | 0.83 | POLB (0.45) | KMT2ACYP3A4CYP2C9CYP2C19PLCG1 | |
| SCHEMBL5298171 | 0.82 | TXNRD1 (0.45) | RXFP1CYP3A4CYP2C9CYP2C19NPSR1 | |
| SCHEMBL5304080 | 0.79 | ALDH1A1 (0.51) | CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL5288284 | 0.77 | TXNRD1 (0.47) | KMT2AMEN1NPSR1TXNRD1L3MBTL1 | |
| SCHEMBL5297694 | 0.77 | PLCG1 (0.44) | KMT2AMEN1RXFP1CYP3A4CYP2D6 | |
| SCHEMBL5290607 | 0.75 | ALDH1A1 (0.49) | KMT2AMEN1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5294347 | 0.75 | ALDH1A1 (0.42) | KMT2AMEN1NPSR1TXNRD1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007012724-A1 | 1,2,4-THIADIAZOLE DERIVATIVES ANTIFUNGAL COMPOUNDS, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF | CYTOMICS SYSTEMS (FR) | 2007-02-01 | — | — | WO | claimed |
| WO-2007012724-A1 | 1,2,4-THIADIAZOLE DERIVATIVES ANTIFUNGAL COMPOUNDS, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF | CYTOMICS SYSTEMS (FR) | 2007-02-01 | — | — | WO | disclosed |