Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.67 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 6/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | PARP1 | P09874 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | SCD | O00767 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.54 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9745549 | 1.00 | MAPT (0.67) | MAPTADORA3ROCK1MEN1KMT2A | |
| SCHEMBL20723591 | 0.81 | PTPN1 (0.47) | MAPTMEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL8823169 | 0.80 | MAPT (1.00) | MAPTADORA3ROCK1MEN1KMT2A | |
| SCHEMBL9460181 | 0.77 | MAPT (0.69) | MAPTADORA3ROCK1MEN1KMT2A | |
| SCHEMBL10813540 | 0.76 | MAPT (0.88) | MAPTADORA3ROCK1MEN1KMT2A | |
| SCHEMBL10921715 | 0.76 | MAPT (0.72) | MAPTADORA3MEN1KMT2AALDH1A1 | |
| SCHEMBL3823589 | 0.76 | MAPT (0.72) | MAPTADORA3MEN1KMT2AALDH1A1 | |
| SCHEMBL1270375 | 0.76 | SCD (0.89) | MAPTADORA3MEN1KMT2AALDH1A1 | |
| SCHEMBL15400878 | 0.75 | LMNA (0.73) | MAPTADORA3MEN1KMT2ALMNA | |
| SCHEMBL2554855 | 0.74 | ROCK1 (1.00) | MAPTADORA3ROCK1MEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5116827-A | Antitumor agents | AMERICAN CYANAMID COMPANY (US) | 1992-05-26 | — | — | US | disclosed |
| US-5077282-A | Improved water or lipid solubility and reduced toxicity | AMERICAN CYANAMID COMPANY (US) | 1991-12-31 | — | — | US | disclosed |
| US-5070082-A | PHOSPHORYLATED DERIVATIVE OF PENTAMIDINE | AMERICAN CYANAMID COMPANY (US) | 1991-12-03 | — | — | US | disclosed |
| EP-0338372-A2 | Solubilized pro-drugs | AMERICAN CYANAMID COMPANY (US) | 1989-10-25 | — | — | EP | disclosed |