Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 7/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 7/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | BCR | P11274 | 1/20 | 0.33 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.33 |
| ▸ | PLA2G4A | P47712 | 2/20 | 0.33 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19041601 | 0.98 | HSD17B1 (0.34) | ESR1MEN1KMT2AAPPHSD17B1 | |
| SCHEMBL311937 | 0.82 | ESR1 (0.46) | ESR1MEN1KMT2AAPPHSD17B1 | |
| SCHEMBL311659 | 0.82 | ESR1 (0.46) | ESR1MEN1KMT2AAPPHSD17B1 | |
| SCHEMBL10263396 | 0.80 | MGLL (0.45) | ESR1MEN1KMT2AHSD17B1HSD17B2 | |
| SCHEMBL14644147 | 0.79 | TRIM58 (0.33) | ESR1MEN1KMT2AHSD17B1HSD17B2 | |
| SCHEMBL23432303 | 0.78 | MEN1 (0.48) | ESR1MEN1KMT2AAPPHSD17B1 | |
| SCHEMBL20431790 | 0.78 | MEN1 (0.48) | ESR1MEN1KMT2AAPPHSD17B1 | |
| SCHEMBL17193902 | 0.78 | HPRT1 (0.36) | — | |
| SCHEMBL14958604 | 0.78 | MEN1 (0.48) | ESR1MEN1KMT2AAPPHSD17B1 | |
| SCHEMBL22173462 | 0.78 | MEN1 (0.48) | ESR1MEN1KMT2AAPPHSD17B1 |
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-2020148243-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-07-23 | — | — | WO | disclosed |