Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL933299 | 0.84 | RAB9A (0.74) | RAB9ALMNAL3MBTL1TSHRHTT | |
| SCHEMBL27886037 | 0.81 | TDP1 (0.73) | RAB9ALMNAL3MBTL1TSHRHTT | |
| SCHEMBL2952697 | 0.78 | TSHR (0.69) | RAB9ALMNAL3MBTL1TSHRHTT | |
| SCHEMBL18286177 | 0.77 | ALDH1A1 (0.69) | RAB9ALMNAL3MBTL1TSHRHTT | |
| SCHEMBL5238404 | 0.76 | GCK (0.59) | RAB9ALMNAALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL2944497 | 0.76 | TDP1 (0.71) | RAB9ALMNAL3MBTL1TSHRHTT | |
| SCHEMBL2188598 | 0.76 | TDP1 (0.71) | RAB9ALMNAL3MBTL1TSHRHTT | |
| SCHEMBL29883158 | 0.76 | TDP1 (0.71) | RAB9ALMNAL3MBTL1TSHRHTT | |
| SCHEMBL18286242 | 0.75 | HTT (0.45) | RAB9ALMNAL3MBTL1TSHRHTT | |
| SCHEMBL17485643 | 0.74 | L3MBTL1 (0.64) | RAB9ALMNAL3MBTL1TSHRHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3302468-A1 | SMALL MOLECULE ANALOGS OF THE NEMO BINDING PEPTIDE | The Scripps Research Institute (US) | 2018-04-11 | — | — | EP | disclosed |
| WO-2016196117-A1 | SMALL MOLECULE ANALOGS OF THE NEMO BINDING PEPTIDE | THE SCRIPPS RESEARCH INSTITUTE (US) | 2016-12-08 | — | — | WO | disclosed |