Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN5 | P54829 | 3/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | PNMT | P11086 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.41 |
| ▸ | ACP3 | P15309 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | BRD2 | P25440 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 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 | |
|---|---|---|---|---|
| SCHEMBL29755658 | 0.89 | PTPN5 (0.48) | PTPN5CES2PNMTMEN1KMT2A | |
| SCHEMBL1044909 | 0.86 | PNMT (0.61) | PTPN5CES2PNMTACP3DAO | |
| SCHEMBL1535283 | 0.86 | PNMT (0.61) | PTPN5CES2PNMTACP3DAO | |
| SCHEMBL343403 | 0.86 | PNMT (0.61) | PTPN5CES2PNMTACP3DAO | |
| SCHEMBL29404730 | 0.86 | PNMT (0.61) | PTPN5CES2PNMTACP3DAO | |
| SCHEMBL475370 | 0.84 | HDAC4 (0.46) | PTPN5CES2PNMTMEN1KMT2A | |
| SCHEMBL19766262 | 0.80 | PTPN5 (0.44) | PTPN5CES2PNMTMEN1KMT2A | |
| SCHEMBL20812100 | 0.80 | PNMT (0.42) | PTPN5CES2PNMTACP3ACHE | |
| SCHEMBL31085000 | 0.77 | SCN10A (0.41) | PTPN5CES2PNMTMEN1KMT2A | |
| SCHEMBL9331659 | 0.76 | UGT2B7 (0.56) | PTPN5MEN1KMT2AUGT2B7BRD4 |
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-2023154344-A1 | 2-METHYL-4',5'-DIHYDROSPIRO[PIPERIDINE-4,7'-THIENO[2,3-C]PYRAN] DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-08-17 | — | — | WO | disclosed |