Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | DBH | P09172 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL21723420 | 0.89 | HSP90AA1 (0.46) | ALDH1A1KDM4ECYP1A2CYP2D6L3MBTL1 | |
| SCHEMBL21724251 | 0.88 | ALDH1A1 (0.49) | MAPTGAAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL21724450 | 0.86 | TAS2R14 (0.39) | ALDH1A1KDM4ESMN1; SMN2DBHHSP90AA1 | |
| SCHEMBL21723463 | 0.85 | KDM4E (0.49) | HTTALDH1A1KDM4E | |
| SCHEMBL21723721 | 0.83 | ALDH1A1 (0.48) | ALDH1A1KDM4ESMN1; SMN2HSP90AA1LMNA | |
| SCHEMBL21723690 | 0.83 | ALDH1A1 (0.43) | HTTMAPTALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL21723580 | 0.83 | TSHR (0.47) | GAAALDH1A1TDP1HSP90AA1LMNA | |
| SCHEMBL21723880 | 0.81 | PTPN1 (0.45) | HTTALDH1A1KDM4ESMN1; SMN2HSP90AA1 | |
| SCHEMBL21723648 | 0.79 | ALDH1A1 (0.48) | HTTALDH1A1TDP1SMN1; SMN2HSP90AA1 | |
| SCHEMBL21723914 | 0.79 | PYCR1 (0.41) | HTTMAPTGAAALDH1A1KDM4E |
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 |