Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 8/20 | 0.46 |
| ▸ | FAAH | O00519 | 5/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | XBP1 | P17861 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL460703 | 0.80 | ALDH1A1 (0.34) | MGLLFAAHALDH1A1LMNAMAPT | |
| SCHEMBL16195830 | 0.78 | MGLL (0.46) | MGLLFAAHHSP90AA1TLR9ALDH1A1 | |
| SCHEMBL16095877 | 0.75 | DRD2 (0.36) | MGLLFAAHHSP90AA1TLR9ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL31374708 | 0.75 | PTGS1 (0.46) | MGLLFAAHHSP90AA1TLR9ALDH1A1 | |
| SCHEMBL28283750 | 0.73 | GRIK1 (0.44) | FAAHMAPT | |
| SCHEMBL29282406 | 0.73 | GRIK1 (0.44) | FAAHMAPT | |
| SCHEMBL3522571 | 0.73 | GSR (0.36) | — | |
| SCHEMBL21320250 | 0.73 | MGLL (0.63) | MGLLFAAHHSP90AA1TLR9ALDH1A1 | |
| SCHEMBL22973514 | 0.72 | AKT1 (0.42) | MGLLFAAHHSP90AA1TLR9ALDH1A1 | |
| SCHEMBL2158216 | 0.71 | GRIK1 (0.42) | FAAHTP53MAPT |
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-2968591-A1 | CELL PROLIFERATION INHIBITORS AND CONJUGATES THEREOF | Novartis AG (CH) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014151030-A1 | CELL PROLIFERATION INHIBITORS AND CONJUGATES THEREOF | NOVARTIS AG (CH) | 2014-09-25 | — | — | WO | disclosed |