Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.51 |
| ▸ | ACP1 | P24666 | 1/20 | 0.51 |
| ▸ | CDC25B | P30305 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 15/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | CRHBP | P24387 | 2/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL12690929 | 1.00 | PTPN1 (0.51) | PTPN1ACP1CDC25BALDH1A1NPSR1 | |
| SCHEMBL10995517 | 0.80 | PTPN1 (0.46) | PTPN1ACP1CDC25BALDH1A1NPSR1 | |
| SCHEMBL13940441 | 0.79 | PTPN1 (0.42) | PTPN1ACP1CDC25BALDH1A1NPSR1 | |
| SCHEMBL70825 | 0.77 | PTPN1 (0.56) | PTPN1ACP1CDC25BALDH1A1CYP1A2 | |
| SCHEMBL13416911 | 0.74 | ALDH1A1 (0.47) | PTPN1ACP1CDC25BALDH1A1NPSR1 | |
| SCHEMBL12033657 | 0.74 | PTPN1 (0.41) | PTPN1ACP1CDC25BALDH1A1NPSR1 | |
| SCHEMBL12254198 | 0.73 | SMN1; SMN2 (0.41) | PTPN1ACP1CDC25BALDH1A1NPSR1 | |
| SCHEMBL12511298 | 0.73 | SMN1; SMN2 (0.39) | PTPN1ACP1CDC25BALDH1A1NPSR1 | |
| SCHEMBL18815074 | 0.73 | SMN1; SMN2 (0.39) | PTPN1ACP1CDC25BALDH1A1NPSR1 | |
| SCHEMBL13940436 | 0.71 | PTPN1 (0.39) | PTPN1ACP1CDC25BALDH1A1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3687980-B1 | RADIOLABELED DARAPLADIB, ANALOGS THEREOF AND THEIR USE AS IMAGING COMPOUNDS | INST NAT SANTE RECH MED (FR) | 2022-01-19 | — | — | EP | disclosed |