Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | STS | P08842 | 3/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | GALR3 | O60755 | 1/20 | 0.31 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | UBE2N | P61088 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | HTR1D | P28221 | 1/20 | 0.30 |
| ▸ | HTR1B | P28222 | 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 | |
|---|---|---|---|---|
| SCHEMBL21723880 | 0.89 | PTPN1 (0.45) | MEN1ALDH1A1KMT2APTPN1HSP90AA1 | |
| SCHEMBL21724251 | 0.85 | ALDH1A1 (0.49) | MEN1ALDH1A1KMT2AHSP90AA1PDE5A | |
| SCHEMBL21723869 | 0.81 | GRIN1 (0.37) | ALDH1A1RAB9AHSD17B2CYP1A2ALPL | |
| SCHEMBL21723420 | 0.79 | HSP90AA1 (0.46) | ALDH1A1KMT2AHSP90AA1CYP1A2 | |
| SCHEMBL21723980 | 0.79 | CA2 (0.45) | ALDH1A1HSP90AA1HSD17B2 | |
| SCHEMBL21724450 | 0.77 | TAS2R14 (0.39) | MEN1ALDH1A1KMT2APPARAHSP90AA1 | |
| SCHEMBL21723463 | 0.76 | KDM4E (0.49) | MEN1ALDH1A1KMT2A | |
| SCHEMBL21723953 | 0.76 | HTT (0.41) | ALDH1A1HSP90AA1CYP1A2TSHR | |
| SCHEMBL21724331 | 0.73 | PYCR1 (0.39) | MEN1ALDH1A1KMT2AHSP90AA1PYCR1 | |
| SCHEMBL21724804 | 0.72 | DAO (0.43) | ALDH1A1PPARAPYCR1RAB9A |
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-2020035826-A1 | 1,2-DITHIOLONE COMPOUNDS AND USE THEREOF | PI INDUSTRIES LTD. (IN) | 2020-02-20 | — | — | WO | claimed |
| WO-2020035826-A1 | 1,2-DITHIOLONE COMPOUNDS AND USE THEREOF | PI INDUSTRIES LTD. (IN) | 2020-02-20 | — | — | WO | disclosed |