Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.61 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.58 |
| ▸ | MAOA | P21397 | 4/20 | 0.58 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.55 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CHUK | O15111 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 3/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12464614 | 0.89 | MAPT (0.64) | HASPINDYRK1AMAOAROCK2MAOB | |
| SCHEMBL19430990 | 0.84 | ALDH1A1 (0.63) | HASPINDYRK1AMAOAMAPTKDM4E | |
| SCHEMBL1609661 | 0.80 | ADORA3 (0.54) | HASPINDYRK1AMAOAROCK2MAOB | |
| SCHEMBL16093621 | 0.80 | HASPIN (0.54) | HASPINDYRK1AMAOAROCK2MAOB | |
| SCHEMBL4166596 | 0.80 | HASPIN (0.71) | HASPINDYRK1AMAOAROCK2MAOB | |
| SCHEMBL24277272 | 0.80 | DYRK1A (0.57) | HASPINDYRK1AMAOAROCK2MAOB | |
| SCHEMBL29445173 | 0.80 | DYRK1A (0.57) | HASPINDYRK1AMAOAROCK2MAOB | |
| SCHEMBL16093663 | 0.78 | DYRK1A (0.52) | HASPINDYRK1AMAOAMAOBMAPT | |
| SCHEMBL17109975 | 0.78 | ADORA3 (0.51) | HASPINDYRK1AMAOAROCK2ACHE | |
| SCHEMBL4166593 | 0.78 | HASPIN (0.52) | HASPINDYRK1AMAOAROCK2MAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017168245-A1 | PHARMACEUTICAL COMPOSITIONS AND METHODS FOR THE TREATMENT OF DIABETES | UNIVERSITY OF LIMERICK (IE) | 2017-10-05 | — | — | WO | disclosed |
| EP-2328894-A1 | BETA-CARBOLIN-DERIVATES AS SUBSTRATES FOR AN ENZYME | Julius-Maximilians-Universität Würzburg (DE) | 2011-06-08 | — | — | EP | disclosed |