Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL9545528 | 0.86 | GSK3B (0.38) | PDK2CYP1A2CYP2C19KMT2A | |
| SCHEMBL9198107 | 0.68 | NFKB1 (0.46) | PDK2CYP1A2CYP2C19KMT2A | |
| SCHEMBL9198100 | 0.68 | NFKB1 (0.46) | PDK2CYP1A2CYP2C19KMT2A | |
| SCHEMBL9545138 | 0.67 | CYP19A1 (0.37) | PDK2CYP1A2CYP2C19KMT2A | |
| SCHEMBL9545130 | 0.67 | CYP19A1 (0.37) | PDK2CYP1A2CYP2C19KMT2A | |
| SCHEMBL9201072 | 0.66 | CYP2A6 (0.35) | PDK2CYP1A2CYP2C19KMT2A | |
| SCHEMBL9545522 | 0.65 | — | — | |
| SCHEMBL19009214 | 0.62 | PDK2 (0.42) | PDK2CYP1A2CYP2C19KMT2A | |
| SCHEMBL5172903 | 0.62 | MAP4K4 (0.43) | CYP1A2CYP2C19 | |
| SCHEMBL30658986 | 0.61 | PDK2 (0.44) | PDK2CYP1A2CYP2C19KMT2A |
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-1993021185-A1 | SUBSTITUTED NITROGEN CONTAINING SPIRO COMPOUNDS FOR USE IN TREATING COGNITIVE DEFICITS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-10-28 | — | — | WO | disclosed |