Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23197033 | 0.94 | PLA2G2A (0.32) | — | |
| SCHEMBL23196854 | 0.93 | KDM4E (0.31) | — | |
| SCHEMBL23196788 | 0.90 | GAA (0.32) | — | |
| SCHEMBL23197012 | 0.89 | PIK3CD (0.33) | CYP1A2CYP3A4NPSR1 | |
| SCHEMBL23197225 | 0.89 | HPSE (0.32) | — | |
| SCHEMBL22913968 | 0.87 | PRKDC (0.31) | NPSR1 | |
| SCHEMBL22914106 | 0.86 | KDM4E (0.31) | — | |
| SCHEMBL22913165 | 0.86 | KDM4E (0.31) | NPSR1 | |
| SCHEMBL23196901 | 0.84 | TP53 (0.32) | — | |
| SCHEMBL23196981 | 0.83 | PIK3CD (0.33) | — |
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-2021066397-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2021-04-08 | — | — | WO | disclosed |