Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.58 |
| ▸ | NSD2 | O96028 | 4/20 | 0.58 |
| ▸ | LMNA | P02545 | 4/20 | 0.58 |
| ▸ | MITF | O75030 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | CASP3 | P42574 | 3/20 | 0.58 |
| ▸ | SENP8 | Q96LD8 | 3/20 | 0.58 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.58 |
| ▸ | SENP6 | Q9GZR1 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 9/20 | 0.48 |
| ▸ | APAF1 | O14727 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8631267 | 0.88 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL16297003 | 0.85 | MAPT (0.68) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL16297128 | 0.84 | LMNA (0.77) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL19628263 | 0.83 | ALDH1A1 (0.67) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL11213879 | 0.82 | KMT2A (0.48) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL16297131 | 0.82 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL11266802 | 0.79 | MAPT (0.51) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL7962344 | 0.78 | MAPT (0.70) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL7964190 | 0.78 | APAF1 (0.51) | ALDH1A1L3MBTL1NSD2LMNAMITF | |
| SCHEMBL16297214 | 0.76 | KMT2A (0.65) | ALDH1A1L3MBTL1NSD2LMNAMITF |
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 |
|---|---|---|---|---|---|---|---|
| US-6174918-B1 | INHIBITING TUMOR CELL GROWTH SENSITIVE TO NAPHTHOQUINONE DERIVATIVE IN MAMMAL BY ADMINISTERING 2,3-DISUBSTITUTED NAPHTHOQUINONE COMPOUND | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL | 2001-01-16 | — | — | US | disclosed |
| US-5789431-A | INHIBITING CELL TUMOR GROWTH | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 1998-08-04 | — | — | US | disclosed |
| WO-1997030022-A1 | NAPHTHOQUINONE ANTITUMOR COMPOUND AND METHOD | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 1997-08-21 | — | — | WO | disclosed |