Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 2/20 | 0.37 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CPA1 | P15085 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27789797 | 0.84 | GRIK1 (0.38) | GRIK1GRIK2CYP2C19CPA1 | |
| SCHEMBL8552491 | 0.82 | GRIK1 (0.31) | GRIK1GRIK2CYP2C19CPA1 | |
| SCHEMBL2557862 | 0.81 | GRIK1 (0.38) | GRIK1GRIK2CYP2C19CPA1ALDH1A1 | |
| SCHEMBL7393306 | 0.81 | HTR2A (0.32) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL27326346 | 0.80 | GRIK1 (0.39) | GRIK1GRIK2CYP2C19CPA1 | |
| SCHEMBL7166743 | 0.79 | GRIK1 (0.41) | GRIK1GRIK2CYP2C19CPA1 | |
| SCHEMBL195784 | 0.79 | GRIK1 (0.37) | GRIK1GRIK2CYP2C19CPA1ADRA2A | |
| Hydrochloric Acid SCHEMBL27547736 | 0.79 | GRIK1 (0.38) | GRIK1GRIK2CYP2C19CPA1 | |
| SCHEMBL7164140 | 0.78 | GRIK1 (0.39) | GRIK1GRIK2CYP2C19CPA1 | |
| SCHEMBL466127 | 0.78 | GRIK1 (0.39) | GRIK1GRIK2CYP2C19CPA1 |
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-5114428-A | Oxidation color dyes with carriers containing soaps, cationic polymers and amines for stabilization | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1992-05-19 | — | — | US | disclosed |