Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TPSAB1 | Q15661 | 6/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21348133 | 0.83 | L3MBTL1 (0.41) | L3MBTL1TPSAB1HDAC3HDAC1SMYD3 | |
| SCHEMBL19940362 | 0.81 | TPSAB1 (0.37) | L3MBTL1TPSAB1HDAC3HDAC1NCOR2 | |
| SCHEMBL21348134 | 0.78 | ITGB3 (0.44) | TPSAB1NPC1 | |
| SCHEMBL19939614 | 0.78 | ITGB3 (0.44) | TPSAB1NPC1 | |
| SCHEMBL14679155 | 0.71 | L3MBTL1 (0.71) | L3MBTL1HDAC3HDAC1NCOR2HDAC2 | |
| SCHEMBL11966134 | 0.70 | L3MBTL1 (0.73) | L3MBTL1HDAC3HDAC1NCOR2HDAC2 | |
| SCHEMBL18235890 | 0.70 | L3MBTL1 (0.73) | L3MBTL1HDAC3HDAC1NCOR2HDAC2 | |
| SCHEMBL11893 | 0.70 | L3MBTL1 (0.68) | L3MBTL1HDAC3HDAC1NCOR2HDAC2 | |
| SCHEMBL22793231 | 0.68 | ITGB3 (0.47) | — | |
| SCHEMBL10173715 | 0.67 | GAA (0.50) | LMNAKMT2ANPC1MEN1ALDH1A1 |
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-2018041985-A1 | CHEMOSELECTIVE THIOL-CONJUGATION WITH ALKENE OR ALKYNE-PHOSPHONAMIDATES | FORSCHUNGSVERBUND BERLIN E.V. (DE) | 2018-03-08 | — | — | WO | disclosed |