Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.45 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20007325 | 0.95 | LDHA (0.49) | LDHAENPP3IRAK4ENPP1RAB9A | |
| SCHEMBL21202835 | 0.89 | LDHA (0.49) | LDHAENPP3IRAK4ENPP1RAB9A | |
| SCHEMBL21202787 | 0.88 | LDHA (0.50) | LDHAENPP3IRAK4ENPP1RAB9A | |
| SCHEMBL20007323 | 0.87 | LDHA (0.45) | LDHAENPP3IRAK4RAB9ANPC1 | |
| SCHEMBL19833441 | 0.85 | LDHA (0.50) | LDHAENPP3IRAK4ENPP1RAB9A | |
| SCHEMBL21202790 | 0.84 | LDHA (0.51) | LDHAENPP3IRAK4RAB9ANPC1 | |
| SCHEMBL21202809 | 0.83 | LDHA (0.54) | LDHAENPP3ENPP1RAB9ANPC1 | |
| SCHEMBL18015449 | 0.83 | LDHA (0.46) | LDHAENPP3IRAK4ENPP1RAB9A | |
| SCHEMBL23956296 | 0.82 | LDHA (0.50) | LDHAENPP3ENPP1RAB9ANPC1 | |
| SCHEMBL21397943 | 0.82 | LDHA (0.40) | LDHAENPP3IRAK4ENPP1RAB9A |
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-3515925-B1 | BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |