Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACA | Q13085 | 2/20 | 0.33 |
| ▸ | TOP1 | P11387 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23478946 | 0.99 | ACACA (0.33) | ACACATOP1ESR1ESR2CYP19A1 | |
| SCHEMBL23479229 | 0.96 | ALOX5 (0.32) | ALOX5 | |
| SCHEMBL23479225 | 0.95 | ALOX5 (0.33) | ACACAALOX5 | |
| SCHEMBL23478944 | 0.95 | ACACA (0.36) | ACACAESR1ESR2CYP19A1ALOX5 | |
| SCHEMBL23479140 | 0.94 | CYP19A1 (0.31) | CYP19A1 | |
| SCHEMBL23478937 | 0.92 | MEN1 (0.36) | ACACATOP1ESR1ESR2 | |
| SCHEMBL23479238 | 0.91 | ALOX5 (0.35) | ACACACYP19A1ALOX5 | |
| SCHEMBL23479150 | 0.89 | MEN1 (0.33) | — | |
| SCHEMBL23479173 | 0.88 | CYP19A1 (0.30) | CYP19A1 | |
| SCHEMBL23478948 | 0.88 | GP6 (0.31) | — |
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-2021112444-A2 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2021-06-10 | — | — | WO | disclosed |