Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 11/20 | 0.57 |
| ▸ | TTR | P02766 | 1/20 | 0.57 |
| ▸ | BCHE | P06276 | 3/20 | 0.50 |
| ▸ | TGM2 | P21980 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.45 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL873778 | 0.81 | CASP3 (0.52) | CES1TTRBCHEALDH1A1CES2 | |
| SCHEMBL27755786 | 0.78 | ALDH1A1 (0.45) | CES1TTRALDH1A1MEN1USP2 | |
| SCHEMBL26101297 | 0.74 | CES1 (0.47) | CES1TTRBCHETGM2ALDH1A1 | |
| SCHEMBL28252336 | 0.72 | CES1 (1.00) | CES1TTRBCHETGM2ALDH1A1 | |
| SCHEMBL126628 | 0.72 | CES1 (1.00) | CES1TTRBCHETGM2ALDH1A1 | |
| SCHEMBL9853503 | 0.72 | CES1 (0.47) | CES1TTRBCHETGM2ALDH1A1 | |
| SCHEMBL4624937 | 0.72 | CES1 (0.65) | CES1BCHETGM2ALDH1A1CES2 | |
| SCHEMBL2259762 | 0.70 | CES1 (0.59) | CES1TTRBCHETGM2ALDH1A1 | |
| SCHEMBL29711265 | 0.70 | CES1 (0.59) | CES1TTRBCHETGM2ALDH1A1 | |
| SCHEMBL4205713 | 0.69 | DRD2 (0.72) | CES1BCHETGM2ALDH1A1ALDH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1705227-A2 | New dyestuffs and colorants with specific carbonyl compounds | Henkel Kommanditgesellschaft auf Aktien (DE) | 2006-09-27 | — | — | EP | claimed |
| EP-1705227-A2 | New dyestuffs and colorants with specific carbonyl compounds | Henkel Kommanditgesellschaft auf Aktien (DE) | 2006-09-27 | — | — | EP | disclosed |