Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11800247 | 1.00 | NAAA (0.41) | NAAACYP2C19HTTCYP19A1EPHX1 | |
| SCHEMBL11818717 | 0.98 | CYP2C19 (0.44) | NAAACYP2C19HTTCYP19A1EPHX1 | |
| SCHEMBL11818704 | 0.98 | CYP2C19 (0.44) | NAAACYP2C19HTTCYP19A1EPHX1 | |
| SCHEMBL11794602 | 0.98 | CYP2C19 (0.44) | NAAACYP2C19HTTCYP19A1EPHX1 | |
| SCHEMBL11794607 | 0.98 | CYP2C19 (0.44) | NAAACYP2C19HTTCYP19A1EPHX1 | |
| SCHEMBL6650101 | 0.87 | CYP2C19 (0.52) | NAAACYP2C19HTTCYP19A1EPHX1 | |
| SCHEMBL6711347 | 0.87 | CYP2C19 (0.52) | NAAACYP2C19HTTCYP19A1EPHX1 | |
| SCHEMBL27200278 | 0.81 | NAAA (0.57) | NAAACYP2C19HTTEPHX1ALDH1A1 | |
| SCHEMBL19134623 | 0.79 | NAAA (0.51) | NAAACYP2C19HTTCYP19A1EPHX1 | |
| SCHEMBL4202317 | 0.76 | NAAA (0.53) | NAAACYP2C19HTTCYP19A1EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3962354-A | REDUCTION, OXIDATIVE DECYCLIZATION, ALKYL PHENYL ETHER | GIVAUDAN CORPORATION (US) | 1976-06-08 | — | — | US | disclosed |