Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP7 | P09237 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | PLA2G7 | Q13093 | 5/20 | 0.34 |
| ▸ | FPR1 | P21462 | 2/20 | 0.34 |
| ▸ | FPR2 | P25090 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4760434 | 0.83 | KMT2A (0.38) | ALDH1A1PARP1PLA2G7KMT2A | |
| SCHEMBL7094360 | 0.81 | MMP1 (0.34) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL13572945 | 0.80 | CHRM2 (0.45) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL20721708 | 0.79 | L3MBTL1 (0.36) | BRD4KMT2A | |
| SCHEMBL14275606 | 0.79 | L3MBTL1 (0.36) | BRD4KMT2A | |
| SCHEMBL31441626 | 0.79 | APEX1 (0.50) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL19988429 | 0.79 | MMP2 (0.34) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL31441657 | 0.79 | APEX1 (0.50) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL25101221 | 0.76 | BRD4 (0.56) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL14145837 | 0.76 | BRD4 (0.34) | MMP2MMP1MMP3MMP7MMP9 |
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 |