Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.39 |
| ▸ | HTR3B | O95264 | 2/20 | 0.39 |
| ▸ | HTR3A | P46098 | 2/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.39 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 3/20 | 0.37 |
| ▸ | NOS3 | P29474 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6687968 | 0.78 | ALDH1A1 (0.45) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL6831500 | 0.67 | SRC (0.50) | ALDH1A1PLAUSRCCYP2C19 | |
| SCHEMBL1025545 | 0.66 | CA2 (0.43) | ALDH1A1MEN1KMT2ASRCCA2 | |
| SCHEMBL3068579 | 0.66 | SRC (0.43) | ALDH1A1SRCCA2CA4CA5A | |
| Azobenzene SCHEMBL29181664 | 0.65 | ALDH1A1 (0.67) | ALDH1A1MEN1KMT2ANPC1SRC | |
| SCHEMBL5353216 | 0.65 | ALDH1A1 (0.43) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| Azobenzene SCHEMBL182577 | 0.64 | ALDH1A1 (0.92) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| Azobenzene SCHEMBL182578 | 0.64 | ALDH1A1 (0.92) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL7079122 | 0.64 | GRIN2B (0.41) | ALDH1A1CA2MIF | |
| SCHEMBL342310 | 0.63 | CA2 (0.52) | ALDH1A1HTR3EHTR3BHTR3AHTR3D |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003060191-A2 | NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |