Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | GSK3B | P49841 | 2/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.59 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29633572 | 0.79 | ADRB2 (0.55) | ALDH1A1HIF1AADRB2ADRB1LMNA | |
| SCHEMBL504837 | 0.79 | ADRB2 (0.55) | ALDH1A1HIF1AADRB2ADRB1LMNA | |
| SCHEMBL342944 | 0.79 | ADRB2 (0.55) | ALDH1A1HIF1AADRB2ADRB1LMNA | |
| SCHEMBL15943179 | 0.79 | ADRB2 (0.55) | ALDH1A1HIF1AADRB2ADRB1LMNA | |
| SCHEMBL316799 | 0.79 | ADRB2 (0.55) | ALDH1A1HIF1AADRB2ADRB1LMNA | |
| Hydrochloric Acid SCHEMBL27661972 | 0.77 | ADRB2 (0.53) | ALDH1A1HIF1AADRB2ADRB1LMNA | |
| Phenacyl Chloride SCHEMBL2314766 | 0.77 | ALDH1A1 (1.00) | ALDH1A1GSK3BMAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL55444 | 0.77 | ALDH1A1 (1.00) | ALDH1A1GSK3BMAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL4787265 | 0.75 | ALDH1A1 (0.86) | ALDH1A1GSK3BMAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL5139857 | 0.75 | ALDH1A1 (0.95) | ALDH1A1GSK3BMAPK1HIF1ATRPA1 |
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-1747224-A1 | COMPLEXES OF RUTHENIUM WITH 2-(AMINOMETHYL)PYRIDINES AND PHOSPHINES, THEIR PREPARATION AND USE AS CATALYSTS | Universita' Degli Studi di Udine (IT) | 2007-01-31 | — | — | EP | disclosed |
| WO-2005105819-A1 | COMPLEXES OF RUTHENIUM WITH 2-(AMINOMETHYL)PYRIDINES AND PHOSPHINES, THEIR PREPARATION AND USE AS CATALYSTS | UNIVERSITA' DEGLI STUDI DI UDINE (IT) | 2005-11-10 | — | — | WO | disclosed |