Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.58 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.54 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.54 |
| ▸ | KIF11 | P52732 | 3/20 | 0.47 |
| ▸ | LDHA | P00338 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | GRM8 | O00222 | 1/20 | 0.45 |
| ▸ | GRM6 | O15303 | 1/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | F3 | P13726 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Anisaldehyde SCHEMBL8037521 | 1.00 | ALDH1A1 (0.58) | ALDH1A1CYP2A6GRIK1GRIK2KIF11 | |
| Anisaldehyde SCHEMBL27955060 | 0.87 | ALDH1A1 (0.56) | ALDH1A1CYP2A6GRIK1GRIK2KIF11 | |
| Anisaldehyde SCHEMBL27955059 | 0.87 | ALDH1A1 (0.56) | ALDH1A1CYP2A6GRIK1GRIK2KIF11 | |
| Anisaldehyde SCHEMBL7617228 | 0.85 | GSR (0.53) | ALDH1A1CYP2A6GRIK1GRIK2KIF11 | |
| Anisaldehyde SCHEMBL7617225 | 0.85 | GSR (0.53) | ALDH1A1CYP2A6GRIK1GRIK2KIF11 | |
| Diaminopropanoic Acid SCHEMBL8035556 | 0.84 | GRIK1 (0.59) | ALDH1A1GRIK1GRIK2SLC1A5NPC1 | |
| Diaminopropanoic Acid SCHEMBL8035562 | 0.84 | GRIK1 (0.59) | ALDH1A1GRIK1GRIK2SLC1A5NPC1 | |
| Diaminopropanoic Acid SCHEMBL8039131 | 0.83 | CYP2A6 (0.53) | ALDH1A1CYP2A6GRIK1GRIK2KIF11 | |
| Diaminopropanoic Acid SCHEMBL8039134 | 0.83 | CYP2A6 (0.53) | ALDH1A1CYP2A6GRIK1GRIK2KIF11 | |
| Anisaldehyde SCHEMBL7798026 | 0.82 | ALDH1A1 (0.68) | ALDH1A1CYP2A6THRBATMGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| US-6127381-A | A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY | LION BIOSCIENCE AG (DE) | 2000-10-03 | — | — | US | disclosed |