Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.33 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Cyclohexylamine SCHEMBL8041402 | 1.00 | CYP2A6 (0.44) | CYP2A6CYP2A13EPHX1KIF11GRIK1 | |
| Lysine SCHEMBL8039160 | 0.88 | GSR (0.42) | CYP2A6CYP2A13EPHX1KIF11ALDH1A1 | |
| Lysine SCHEMBL8039163 | 0.88 | GSR (0.42) | CYP2A6CYP2A13EPHX1KIF11ALDH1A1 | |
| Cyclohexylamine SCHEMBL8025672 | 0.87 | CYP2A6 (0.50) | CYP2A6CYP2A13EPHX1ALDH1A1KDM4E | |
| 4-Hydroxybenzaldehyde SCHEMBL8037276 | 0.85 | ALDH5A1 (0.41) | KIF11GRIK1ALDH1A1MEN1KMT2A | |
| 4-Hydroxybenzaldehyde SCHEMBL8037281 | 0.85 | ALDH5A1 (0.41) | KIF11GRIK1ALDH1A1MEN1KMT2A | |
| Benzaldehyde SCHEMBL8035694 | 0.85 | KIF11 (0.42) | CYP2A6KIF11GRIK1ALDH1A1MEN1 | |
| Cyclohexylamine SCHEMBL8037511 | 0.84 | GRIK1 (0.42) | EPHX1KIF11GRIK1ALDH1A1MEN1 | |
| Cyclohexylamine SCHEMBL8037697 | 0.84 | GRIK1 (0.41) | KIF11GRIK1ALDH1A1MAPTKMT2A | |
| Cyclohexylamine SCHEMBL8037696 | 0.84 | GRIK1 (0.41) | KIF11GRIK1ALDH1A1MAPTKMT2A |
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 |