Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10588572 | 0.81 | ALDH1A1 (0.36) | ALDH1A1MAPTTDP1 | |
| SCHEMBL670463 | 0.77 | PTGDR (0.33) | ALDH1A1MAPTTDP1GABRA1GABRB2 | |
| SCHEMBL10690750 | 0.76 | ALDH1A1 (0.39) | ALDH1A1MAPTTDP1GABRA1GABRB2 | |
| SCHEMBL10695160 | 0.74 | GABRA1 (0.48) | ALDH1A1MAPTGABRA1GABRB2 | |
| SCHEMBL9792845 | 0.69 | CYP3A4 (0.32) | ALDH1A1MAPTTDP1 | |
| SCHEMBL1918099 | 0.68 | GABRA1 (0.43) | ALDH1A1MAPTGABRA1GABRB2 | |
| SCHEMBL249069 | 0.66 | TAAR1 (0.44) | ALDH1A1MAPTTDP1GABRA1GABRB2 | |
| SCHEMBL16685089 | 0.66 | GABRA1 (0.39) | ALDH1A1MAPTGABRA1GABRB2 | |
| Methylamine SCHEMBL28377267 | 0.66 | SRD5A1 (0.33) | ALDH1A1MAPTTDP1 | |
| SCHEMBL18546661 | 0.66 | PNMT (0.41) | GABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0284555-A1 | Process for the preparation of N-acyl-N-(oxazoliden-2-on-3-yl)-2,6-dialkyl-3-chloroanilines | CIBA-GEIGY AG (CH) | 1988-09-28 | — | — | EP | disclosed |