Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | RAB9A | P51151 | 4/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.62 |
| ▸ | CASP3 | P42574 | 2/20 | 0.62 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.62 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.62 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | ATM | Q13315 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 2/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29012533 | 0.81 | NPC1 (0.89) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL25934282 | 0.80 | ALDH1A1 (0.57) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL29012535 | 0.76 | NPC1 (0.81) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL29482674 | 0.76 | NPC1 (1.00) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL187755 | 0.76 | NPC1 (1.00) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL13824790 | 0.75 | NPC1 (0.90) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL30811432 | 0.74 | NPC1 (0.76) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL28901166 | 0.74 | MAPK1 (0.57) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL13184457 | 0.73 | NPC1 (0.64) | NPC1RAB9AMAPK1SMN1; SMN2CASP3 | |
| SCHEMBL9240847 | 0.72 | TDP2 (0.43) | ALDH1A1CDC25BIDO1MAOAMAOB |
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-0430164-B1 | Process for preparation of 2-substituted-1,4-naphthoquinone | NIPPON CATALYTIC CHEM IND (JP) | 1995-03-22 | — | — | EP | disclosed |
| US-5329026-A | Oxidation of substituted naphthoquinone, adding a diene compound to reaction product, separation | NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) | 1994-07-12 | — | — | US | disclosed |
| EP-0430164-A2 | Process for preparation of 2-substituted-1,4-naphthoquinone | NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) | 1991-06-05 | — | — | EP | disclosed |