Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.34 |
| ▸ | PLA2G4A | P47712 | 3/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24628064 | 0.96 | ALDH1A1 (0.43) | CYP1A2KDM4EMEN1ALDH1A1TP53 | |
| SCHEMBL24628236 | 0.95 | CYP1A2 (0.43) | CYP1A2KDM4EMEN1ALDH1A1TP53 | |
| SCHEMBL24628555 | 0.93 | PLA2G2A (0.39) | KDM4EMEN1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL24628796 | 0.91 | ALDH1A1 (0.38) | CYP1A2KDM4EMEN1ALDH1A1TP53 | |
| SCHEMBL27278179 | 0.87 | KDM4E (0.38) | CYP1A2KDM4EMEN1ALDH1A1TP53 | |
| SCHEMBL24628245 | 0.87 | ALDH1A1 (0.38) | CYP1A2KDM4EMEN1ALDH1A1TP53 | |
| SCHEMBL24628242 | 0.87 | ALDH1A1 (0.38) | CYP1A2KDM4EMEN1ALDH1A1TP53 | |
| SCHEMBL26589620 | 0.86 | KDM4E (0.39) | CYP1A2KDM4EMEN1ALDH1A1TP53 | |
| SCHEMBL24628082 | 0.86 | PLA2G2A (0.43) | KDM4EMEN1ALDH1A1TP53KMT2A | |
| SCHEMBL24628549 | 0.86 | GP6 (0.37) | KDM4EMEN1ALDH1A1TP53KMT2A |
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-2022148717-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2022-07-14 | — | — | WO | disclosed |