Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.30 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.30 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.30 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.30 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.30 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.30 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.30 |
| ▸ | HTR3B | O95264 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | PRNP | P04156 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL6068645 | 0.78 | — | — | |
| SCHEMBL5422207 | 0.77 | NOS3 (0.34) | ALDH1A1LMNACYP2D6MAPTHTR2A | |
| SCHEMBL14445294 | 0.76 | ALDH1A1 (0.37) | ALDH1A1LMNACYP2D6MAPT | |
| SCHEMBL5422084 | 0.76 | ALDH1A1 (0.37) | ALDH1A1LMNACYP2D6MAPT | |
| SCHEMBL6068673 | 0.74 | SIGMAR1 (0.35) | CNR1 | |
| SCHEMBL6068579 | 0.73 | SMPD3 (0.46) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL5416781 | 0.72 | KDM4E (0.35) | HTR1AADRA1AADRA1DADRA1BHTR3E | |
| SCHEMBL14445301 | 0.68 | RPS6KA5 (0.32) | ADRA1AADRA1BCYP2D6HRH1 | |
| SCHEMBL6068802 | 0.68 | CYP2D6 (0.33) | HTR1AADRA1AADRA1DHTR3ESLC22A2 | |
| SCHEMBL6068845 | 0.67 | CYP2D6 (0.32) | HTR1AADRA1AADRA1DHTR3ESLC22A2 |
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-7091350-B2 | Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres | L'OREAL (FR) | 2006-08-15 | — | — | US | disclosed |