Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7697719 | 0.86 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL7694096 | 0.86 | NPC1 (0.50) | NQO2NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL7689877 | 0.83 | SMN1; SMN2 (0.43) | NQO2NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL7695589 | 0.83 | APP (0.46) | NQO2NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL7697050 | 0.83 | TDP1 (0.44) | NQO2CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7697161 | 0.83 | MAOA (0.43) | NQO2RAB9AL3MBTL1MAPT | |
| SCHEMBL7695424 | 0.80 | CYP1A2 (0.42) | NQO2NPC1RAB9ACYP1A2CYP3A4 | |
| SCHEMBL24115709 | 0.76 | NQO2 (0.49) | NQO2NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL7697058 | 0.75 | RAB9A (0.50) | NQO2NPC1RAB9ASMN1; SMN2L3MBTL1 | |
| SCHEMBL7698500 | 0.75 | SOD1 (0.44) | NQO2NPC1RAB9ASMN1; SMN2CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002094796-A2 | BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES | AXXIMA PHARMACEUTICALS AG (DE) | 2002-11-28 | — | — | WO | disclosed |