Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPS1 | P31327 | 11/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | PRAP1 | Q96NZ9 | 1/20 | 0.45 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | PDE2A | O00408 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | IDH1 | O75874 | 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 | |
|---|---|---|---|---|
| SCHEMBL7877653 | 0.85 | CYP46A1 (0.61) | CPS1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL20460504 | 0.85 | HPGD (0.59) | CPS1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL23775397 | 0.83 | CPS1 (0.51) | CPS1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL24632521 | 0.81 | L3MBTL3 (0.56) | CPS1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL7878686 | 0.81 | CPS1 (0.60) | CPS1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL12205464 | 0.80 | CPS1 (0.58) | CPS1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL18010744 | 0.79 | CPS1 (0.57) | CPS1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL7872416 | 0.79 | CPS1 (0.57) | CPS1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL23734996 | 0.78 | HCRTR1 (0.48) | CPS1ALDH1A1PARP1CYP46A1PDE2A | |
| SCHEMBL23734811 | 0.78 | HCRTR1 (0.48) | CPS1ALDH1A1PARP1CYP46A1PDE2A |
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-2010122069-A1 | 5-ALKYNYL-PYRIDINES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-10-28 | — | — | WO | disclosed |