Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | AXL | P30530 | 1/20 | 0.44 |
| ▸ | SRC | P12931 | 2/20 | 0.42 |
| ▸ | PRKACA | P17612 | 1/20 | 0.42 |
| ▸ | PRKACG | P22612 | 1/20 | 0.42 |
| ▸ | PRKACB | P22694 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 2/20 | 0.41 |
| ▸ | DDO | Q99489 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29638854 | 1.00 | GPR35 (0.50) | GPR35CYP2A6KEAP1AXLSRC | |
| SCHEMBL366714 | 1.00 | GPR35 (0.50) | GPR35CYP2A6KEAP1AXLSRC | |
| Bromide SCHEMBL8431246 | 0.98 | GPR35 (0.48) | GPR35CYP2A6KEAP1AXLSRC | |
| Bromide SCHEMBL9788685 | 0.96 | GPR35 (0.47) | GPR35CYP2A6KEAP1AXLSRC | |
| SCHEMBL11682246 | 0.86 | CYP2A6 (0.44) | GPR35CYP2A6KEAP1AXLDAO | |
| SCHEMBL8520252 | 0.84 | SRC (0.39) | GPR35CYP2A6KEAP1AXLSRC | |
| SCHEMBL2925830 | 0.83 | KEAP1 (0.41) | GPR35CYP2A6KEAP1AXLDAO | |
| SCHEMBL29104555 | 0.83 | CYP2A6 (0.41) | GPR35CYP2A6KEAP1AXLSRC | |
| SCHEMBL8031453 | 0.83 | CYP2A6 (0.50) | GPR35CYP2A6KEAP1AXLDAO | |
| SCHEMBL20084870 | 0.83 | CYP2A6 (0.41) | GPR35CYP2A6KEAP1AXLDAO |
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-5776241-A | MELANIN PIGMENT PARTICLES FOR COSMETICS | L'OREAL (FR) | 1998-07-07 | — | — | US | disclosed |