Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7697058 | 0.86 | RAB9A (0.50) | LMNASMN1; SMN2NPC1RAB9ANQO2 | |
| SCHEMBL7697719 | 0.80 | NPC1 (0.50) | SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9 | |
| SCHEMBL7695424 | 0.77 | CYP1A2 (0.42) | LMNANPC1RAB9ACYP1A2CYP3A4 | |
| SCHEMBL7697050 | 0.77 | TDP1 (0.44) | CYP2A6LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7698500 | 0.76 | SOD1 (0.44) | CYP2A6LMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL7694614 | 0.73 | HTR7 (0.40) | CYP2A6LMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL7698454 | 0.72 | NQO2 (0.45) | LMNASMN1; SMN2NPC1RAB9ACYP1A2 | |
| SCHEMBL7696122 | 0.71 | HPGD (0.43) | CYP2A6LMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL7692496 | 0.70 | SMN1; SMN2 (0.40) | CYP2A6LMNASMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL7697768 | 0.70 | SMN1; SMN2 (0.50) | LMNASMN1; SMN2NPC1RAB9ANQO2 |
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 |