Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 6/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | EGFR | P00533 | 3/20 | 0.47 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | NSD2 | O96028 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.43 |
| ▸ | MEN1 | O00255 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10897765 | 0.83 | ADORA2A (0.44) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL83136 | 0.81 | ADORA2A (0.53) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL11696176 | 0.80 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL20091654 | 0.79 | PDK2 (0.50) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL30038904 | 0.79 | PDK2 (0.50) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL9213962 | 0.77 | ADORA2A (0.53) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL11108668 | 0.77 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL18242705 | 0.76 | ELANE (0.53) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL11293375 | 0.76 | CDC25B (0.46) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 | |
| SCHEMBL16424117 | 0.76 | ADORA2A (0.57) | ALDH1A1SMN1; SMN2MAPTL3MBTL1MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0348464-B1 | 2-NEOPENTYLANTHRAQUINONE | BASF Aktiengesellschaft (DE) | 1993-03-31 | — | — | EP | disclosed |
| US-5107004-A | 2-NEOPENTYLANTHRAQUINONE, PROCESSES FOR ITS PREPARATION AND METHODS FOR ITS USE | BASF AKTIENGESELLSCHAFT (DE) | 1992-04-21 | — | — | US | disclosed |
| EP-0348464-A1 | 2-NEOPENTYLANTHRAQUINONE | BASF Aktiengesellschaft (DE) | 1990-01-03 | — | — | EP | disclosed |