Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL15564163 | 0.79 | — | — | |
| SCHEMBL4898541 | 0.77 | CYP19A1 (0.41) | CYP19A1HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL12859646 | 0.77 | CYP19A1 (0.41) | CYP19A1HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11884817 | 0.77 | CYP19A1 (0.41) | CYP19A1HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL12464963 | 0.77 | CYP19A1 (0.41) | CYP19A1HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL13176769 | 0.76 | HTT (0.47) | CYP19A1HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27694874 | 0.71 | CYP19A1 (0.51) | CYP19A1HTTCYP3A4PGR | |
| Ethylene SCHEMBL27701965 | 0.67 | HTT (0.46) | CYP19A1HTTCYP2C19CYP3A4TRPA1 | |
| SCHEMBL733508 | 0.66 | — | — | |
| SCHEMBL27481900 | 0.64 | CYP19A1 (0.48) | CYP19A1HTT |
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-2067763-A2 | Method for manufacturing substituted decalin-6-ol-1-on derivatives | Saltigo GmbH (DE) | 2009-06-10 | — | — | EP | disclosed |