Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B2 | P37059 | 1/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23904832 | 0.87 | HSD17B2 (0.48) | HSD17B2PTPN11CA12CA1CA2 | |
| SCHEMBL23905305 | 0.87 | KDM4E (0.44) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL23905741 | 0.85 | HSD17B2 (0.46) | HSD17B2PTPN11CA12CA1CA2 | |
| SCHEMBL23905740 | 0.84 | HSD17B2 (0.45) | HSD17B2PTPN11CA12CA1CA2 | |
| SCHEMBL23905739 | 0.82 | HSD17B2 (0.43) | HSD17B2PTPN11CA12CA1CA2 | |
| SCHEMBL18031363 | 0.80 | HSD17B2 (0.51) | HSD17B2PTPN11CA12CA1CA2 | |
| SCHEMBL23904824 | 0.79 | HSD17B2 (0.47) | HSD17B2CA12CA1CA2CA7 | |
| SCHEMBL25113827 | 0.77 | HSD17B2 (0.48) | HSD17B2CA12CA1CA2CA7 | |
| SCHEMBL23905400 | 0.75 | HSD17B2 (0.49) | HSD17B2CA12CA1CA2CA7 | |
| SCHEMBL23930154 | 0.75 | KDM4E (0.45) | PTPN11CA12CA1CA2CA7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021198981-A1 | ANTIVIRAL COMPOUNDS AND USES THEREOF | Janssen Biopharma, Inc. (US) | 2021-10-07 | — | — | WO | disclosed |