Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | TERT | O14746 | 1/20 | 0.31 |
| ▸ | BCL2 | P10415 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3817562 | 0.87 | NPSR1 (0.42) | MEN1KMT2ACYP1A2MAOACYP2A6 | |
| SCHEMBL3819790 | 0.77 | CFTR (0.34) | MEN1KMT2ASMN1; SMN2TERT | |
| SCHEMBL17165799 | 0.77 | CBLB (0.33) | MEN1KMT2A | |
| SCHEMBL20425444 | 0.76 | MTNR1A (0.42) | KMT2ASMN1; SMN2TERTMAOB | |
| SCHEMBL8487888 | 0.73 | ATM (0.43) | MEN1KMT2ACYP1A2SMN1; SMN2 | |
| SCHEMBL8491351 | 0.73 | TRPA1 (0.43) | MEN1KMT2ACYP2C19MAOASMN1; SMN2 | |
| SCHEMBL9401376 | 0.70 | L3MBTL1 (0.34) | CYP1A2SMN1; SMN2 | |
| SCHEMBL9908227 | 0.70 | CYP2C19 (0.40) | MEN1KMT2ACYP2C19MAOAMAOB | |
| SCHEMBL1129069 | 0.69 | CYP2A6 (0.42) | CYP2C19ALOX5CYP1A2SMN1; SMN2CYP2A6 | |
| SCHEMBL22590138 | 0.67 | CYP2A6 (0.40) | MEN1KMT2ACYP2C19ALOX5CYP1A2 |
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-2091527-A2 | SULFIDE, SULFOXIDE AND SULFONE CHALCONE ANALOGUES, DERIVATIVES THEREOF AND THERAPEUTIC USES THEREOF | Temple University of the Commonwealth System of Higher Education (US) | 2009-08-26 | — | — | EP | disclosed |
| WO-2008076270-A2 | SULFIDE, SULFOXIDE AND SULFONE CHALCONE ANALOGUES, DERIVATIVES THEREOF AND THERAPEUTIC USES THEREOF | TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2008-06-26 | — | — | WO | disclosed |