Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21723690 | 0.95 | ALDH1A1 (0.43) | ALDH1A1POLBSMN1; SMN2RAB9AMAPK1 | |
| SCHEMBL21723420 | 0.92 | HSP90AA1 (0.46) | ALDH1A1KMT2AKDM4EHSP90AA1 | |
| SCHEMBL21724251 | 0.85 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL21724450 | 0.84 | TAS2R14 (0.39) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL21723880 | 0.84 | PTPN1 (0.45) | ALDH1A1SMN1; SMN2RAB9AMEN1KMT2A | |
| SCHEMBL21723953 | 0.83 | HTT (0.41) | ALDH1A1SMN1; SMN2LMNATSHRKDM4E | |
| SCHEMBL21723463 | 0.83 | KDM4E (0.49) | ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL21723580 | 0.83 | TSHR (0.47) | ALDH1A1MAPK1LMNATSHRGLA | |
| SCHEMBL21724539 | 0.80 | SMN1; SMN2 (0.51) | ALDH1A1SMN1; SMN2RAB9ALMNAMEN1 | |
| SCHEMBL21723648 | 0.77 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2MEN1KMT2AHSP90AA1 |
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 |