Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 6/20 | 0.38 |
| ▸ | GRIK2 | Q13002 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | ALPI | P09923 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | XIAP | P98170 | 1/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| 4-Hydroxybenzaldehyde SCHEMBL8037281 | 0.90 | ALDH5A1 (0.41) | KIF11GRIK1GRIK2ALDH1A1SLC7A5 | |
| 4-Hydroxybenzaldehyde SCHEMBL8037276 | 0.90 | ALDH5A1 (0.41) | KIF11GRIK1GRIK2ALDH1A1SLC7A5 | |
| Cyclohexylamine SCHEMBL8041275 | 0.89 | LTA4H (0.40) | KIF11ALDH1A1PPARGPPARA | |
| Cyclohexylamine SCHEMBL8041272 | 0.89 | LTA4H (0.40) | KIF11ALDH1A1PPARGPPARA | |
| 3-Hydroxybenzaldehyde SCHEMBL8039109 | 0.89 | KYNU (0.40) | KIF11PPARGPPARAMEN1KMT2A | |
| 3-Hydroxybenzaldehyde SCHEMBL8039117 | 0.89 | KYNU (0.40) | KIF11PPARGPPARAMEN1KMT2A | |
| Cyclohexylamine SCHEMBL8037511 | 0.88 | GRIK1 (0.42) | KIF11GRIK1GRIK2ALDH1A1MEN1 | |
| Cyclohexylamine SCHEMBL8037514 | 0.88 | GRIK1 (0.42) | KIF11GRIK1GRIK2ALDH1A1MEN1 | |
| Cyclohexylamine SCHEMBL8037416 | 0.88 | ALDH1A1 (0.47) | KIF11GRIK1GRIK2ALDH1A1KMT2A | |
| Cyclohexylamine SCHEMBL8037697 | 0.88 | GRIK1 (0.41) | KIF11GRIK1GRIK2ALDH1A1KMT2A |
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 |