Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA7 | P43166 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.47 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL23905367 | 0.85 | KDM4E (0.49) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL23904831 | 0.80 | CA12 (0.38) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL23905509 | 0.80 | PTPN11 (0.57) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL2805615 | 0.75 | BCL2L1 (0.53) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL30299154 | 0.75 | BCL2L1 (0.53) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL23904842 | 0.75 | PTPN11 (0.43) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL23904844 | 0.75 | S1PR1 (0.47) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL23956780 | 0.75 | CYP1A2 (0.41) | TSHRMAPTALDH1A1CYP1A2NPSR1 | |
| SCHEMBL16055405 | 0.74 | CA12 (0.63) | PTPN11CA12CA1CA2CA7 | |
| SCHEMBL2201187 | 0.74 | KDM4E (0.55) | CA12CA1CA2CA7CA9 |
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 |