Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL10998789 | 0.84 | LTA4H (0.52) | GAALTA4HKCNA3ESR1HTR2A | |
| SCHEMBL10998787 | 0.84 | LTA4H (0.52) | GAALTA4HKCNA3ESR1HTR2A | |
| Ethylene SCHEMBL27839786 | 0.81 | LTA4H (0.49) | GAALTA4HESR1HTR2AHRH1 | |
| SCHEMBL4191032 | 0.79 | LTA4H (0.41) | GAALTA4HKCNA3KDM4E | |
| SCHEMBL11696544 | 0.79 | LTA4H (0.61) | GAALTA4HKDM4E | |
| SCHEMBL11447473 | 0.78 | KDM4E (0.39) | GAAKCNA3KDM4E | |
| SCHEMBL4276749 | 0.78 | KDM4E (0.39) | GAAKCNA3ESR1HTR2AHRH1 | |
| SCHEMBL4833131 | 0.78 | KDM4E (0.39) | GAAKCNA3KDM4E | |
| SCHEMBL9440336 | 0.78 | ALDH1A1 (0.50) | GAALTA4HKCNA3KDM4E | |
| SCHEMBL2742278 | 0.76 | NPC1 (0.41) | GAAKDM4E |
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-1810966-B1 | ALKOXYPROPYL ISOTHIAZOLINONE AND PREPARATION METHOD AND USE THEREOF | OCEAN UNIV CHINA (CN) | 2012-04-25 | — | — | EP | claimed |