Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23341316 | 0.89 | PTGS1 (0.33) | PTGS1ABCC4LMNAGAATSHR | |
| SCHEMBL14228497 | 0.88 | ALDH1A1 (0.46) | PTGS1ABCC4LMNAGAATSHR | |
| SCHEMBL12194691 | 0.87 | BCHE (0.39) | LMNAGAACYP3A4CYP2C9SRD5A2 | |
| SCHEMBL14570728 | 0.86 | CYP3A4 (0.40) | PTGS1LMNAGAAHTTCYP3A4 | |
| SCHEMBL23620701 | 0.86 | AKR1C4 (0.38) | — | |
| SCHEMBL19393548 | 0.86 | LTB4R2 (0.39) | PTGS1ABCC4LMNAGAATSHR | |
| SCHEMBL22060937 | 0.85 | LTB4R2 (0.36) | PTGS1ABCC4LMNAGAATSHR | |
| SCHEMBL22892448 | 0.81 | PTGES (0.38) | PTGS1NR1H4PTGS2 | |
| SCHEMBL13515155 | 0.81 | ESR1 (0.31) | LMNAGAAHTTCYP3A4CYP2C9 | |
| SCHEMBL22355625 | 0.81 | RXRA (0.32) | PTGS1ABCC4LMNAGAATSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-4186898-A1 | COMPOSITION FOR ORGANIC ELECTRONIC COMPOUNDS | Merck Patent GmbH (DE) | 2023-05-31 | — | — | EP | disclosed |