Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK8 | P49336 | 1/20 | 0.55 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.55 |
| ▸ | ACHE | P22303 | 5/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10427929 | 0.90 | CDK8 (0.53) | CDK8CLK4ACHETDP1NPC1 | |
| SCHEMBL10693928 | 0.84 | LTB4R (0.53) | ACHE | |
| SCHEMBL10696013 | 0.84 | CYP3A4 (0.56) | ACHECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10427950 | 0.81 | DRD2 (0.44) | CDK8CLK4ACHE | |
| SCHEMBL10699939 | 0.78 | ACHE (0.49) | CDK8CLK4ACHETDP1MEN1 | |
| SCHEMBL10426976 | 0.76 | ACHE (0.54) | ACHE | |
| SCHEMBL10696001 | 0.76 | ACHE (0.51) | ACHE | |
| SCHEMBL10427884 | 0.76 | LTB4R (0.52) | ACHEMEN1KMT2A | |
| SCHEMBL10427190 | 0.75 | ACHE (0.52) | ACHEKMT2A | |
| SCHEMBL10427932 | 0.75 | LTB4R (0.52) | ACHECYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0259782-A1 | Naphthalene and indane derivatives, medicaments containing these compounds and processes for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-03-16 | — | — | EP | disclosed |