Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 3/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.44 |
| ▸ | DRD1 | P21728 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | IAPP | P10997 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27829507 | 0.89 | DRD3 (0.46) | DRD3SIGMAR1DRD1CA1CA2 | |
| SCHEMBL3362906 | 0.86 | ALOX5 (0.54) | DRD3SIGMAR1DRD1CA1CA2 | |
| SCHEMBL30056497 | 0.86 | ALOX5 (0.54) | DRD3SIGMAR1DRD1CA1CA2 | |
| SCHEMBL11218181 | 0.84 | DRD3 (0.43) | DRD3SIGMAR1DRD1CA1CA2 | |
| SCHEMBL25297854 | 0.84 | TNKS2 (0.39) | CA2TNKS2 | |
| SCHEMBL28328703 | 0.83 | ALOX5 (0.59) | ALOX5PTGS2KDM4ETP53CYP3A4 | |
| SCHEMBL27981225 | 0.83 | ALOX5 (0.59) | ALOX5PTGS2KDM4ETP53CYP3A4 | |
| SCHEMBL15228953 | 0.83 | ALOX5 (0.59) | ALOX5PTGS2KDM4ETP53CYP3A4 | |
| SCHEMBL985240 | 0.82 | ALDH1A1 (0.51) | CA1CA2ALOX5PTGS2KDM4E | |
| SCHEMBL23964582 | 0.82 | PTGER4 (0.43) | CA1CA2ALOX5PTGS2KDM4E |
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-3331855-A1 | NEW ANIONIC SURFACTANTS AND DETERGENTS COMPRISING THEM | Henkel AG & Co. KGaA (DE) | 2018-06-13 | — | — | EP | disclosed |