Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 2/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 2/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29540911 | 0.83 | — | — | |
| SCHEMBL87096 | 0.83 | — | — | |
| SCHEMBL30039913 | 0.83 | — | — | |
| SCHEMBL20465749 | 0.83 | — | — | |
| Ammonia Solution, Strong SCHEMBL30950130 | 0.81 | MEN1 (0.60) | ERN1NFE2L2LMNAMEN1THRB | |
| Hydrazine SCHEMBL28489396 | 0.77 | MEN1 (0.55) | ERN1NFE2L2LMNAMEN1THRB | |
| Methyl Alcohol SCHEMBL27933061 | 0.77 | ERN1 (0.59) | ERN1NFE2L2LMNAMEN1THRB | |
| SCHEMBL4729357 | 0.75 | ERN1 (0.57) | ERN1NFE2L2LMNAMEN1THRB | |
| Dimethylamine SCHEMBL9452721 | 0.75 | MEN1 (0.52) | ERN1NFE2L2LMNAMEN1THRB | |
| Biphenyl SCHEMBL29187632 | 0.75 | LMNA (0.52) | ERN1NFE2L2LMNAMEN1THRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-104812746-A | Bruton's tyrosine kinase inhibitors | HOFFMANN LA ROCHE | 2015-07-29 | — | — | CN | disclosed |