Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | UNG | P13051 | 1/20 | 0.35 |
| ▸ | GRK2 | P25098 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 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 SCHEMBL8039363 | 1.00 | ALDH1A1 (0.47) | ALDH1A1POLBMEN1KMT2AHSD17B3 | |
| Lysine SCHEMBL8037742 | 0.88 | ALDH1A1 (0.42) | ALDH1A1POLBMEN1KMT2AMAOA | |
| Lysine SCHEMBL8037738 | 0.88 | ALDH1A1 (0.42) | ALDH1A1POLBMEN1KMT2AMAOA | |
| Cyclohexylamine SCHEMBL7798152 | 0.88 | ALDH1A1 (0.51) | ALDH1A1POLBMEN1KMT2AHSD17B3 | |
| Benzaldehyde SCHEMBL8035694 | 0.88 | KIF11 (0.42) | ALDH1A1MEN1KMT2AKIF11PKM | |
| 3-Hydroxybenzaldehyde SCHEMBL8039109 | 0.87 | KYNU (0.40) | POLBMEN1KMT2AKIF11UNG | |
| 3-Hydroxybenzaldehyde SCHEMBL8039117 | 0.87 | KYNU (0.40) | POLBMEN1KMT2AKIF11UNG | |
| Cyclohexylamine SCHEMBL8037511 | 0.87 | GRIK1 (0.42) | ALDH1A1MEN1KMT2AKIF11AAK1 | |
| Cyclohexylamine SCHEMBL8037514 | 0.87 | GRIK1 (0.42) | ALDH1A1MEN1KMT2AKIF11AAK1 | |
| 3-Formylbenzoic Acid SCHEMBL8035774 | 0.86 | UNG (0.54) | UNG |
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 |