Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 16/20 | 0.37 |
| ▸ | RARB | P10826 | 6/20 | 0.37 |
| ▸ | RARG | P13631 | 6/20 | 0.37 |
| ▸ | RXRB | P28702 | 6/20 | 0.37 |
| ▸ | RXRG | P48443 | 5/20 | 0.37 |
| ▸ | RARA | P10276 | 5/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26592538 | 0.87 | RXRA (0.44) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL21042627 | 0.85 | PRKCI (0.34) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL20109727 | 0.82 | RXRA (0.34) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL11599145 | 0.78 | RXRA (0.42) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL23927691 | 0.75 | RXRA (0.41) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL8122874 | 0.73 | RARB (0.51) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL7622765 | 0.70 | RXRA (0.48) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL18612731 | 0.70 | RXRA (0.41) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL9867812 | 0.69 | PTK2 (0.44) | RXRARARBRARGRXRBRXRG | |
| SCHEMBL15347776 | 0.69 | RXRA (0.50) | RXRARARBRARGRXRBRXRG |
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-2018019688-A1 | METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENCE DEVICES | MERCK PATENT GMBH (DE) | 2018-02-01 | — | — | WO | disclosed |