Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 7/20 | 0.50 |
| ▸ | CA2 | P00918 | 7/20 | 0.50 |
| ▸ | CA12 | O43570 | 5/20 | 0.50 |
| ▸ | CA9 | Q16790 | 4/20 | 0.50 |
| ▸ | CA4 | P22748 | 3/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 5/20 | 0.46 |
| ▸ | NOS3 | P29474 | 4/20 | 0.46 |
| ▸ | NOS2 | P35228 | 2/20 | 0.46 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL3959544 | 0.84 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2D6CYP2C19HDAC1 | |
| SCHEMBL4232031 | 0.80 | TDP1 (0.51) | CYP1A2CYP3A4CYP2D6CYP2C19HDAC1 | |
| SCHEMBL15265159 | 0.76 | CA1 (0.46) | CYP1A2CYP3A4CYP2D6CYP2C19HDAC1 | |
| SCHEMBL11295118 | 0.73 | CHRM2 (0.67) | CYP1A2CYP3A4CYP2D6CYP2C19HDAC1 | |
| SCHEMBL5002919 | 0.73 | CASR (0.44) | CA1CA2CA12CA9CA4 | |
| SCHEMBL5002916 | 0.73 | CASR (0.44) | CA1CA2CA12CA9CA4 | |
| SCHEMBL2538044 | 0.73 | CYP1A2 (0.62) | CYP1A2CYP3A4CYP2D6CYP2C19HDAC1 | |
| SCHEMBL3963878 | 0.73 | TAAR1 (0.54) | CYP1A2CYP3A4CYP2D6CYP2C19HDAC1 | |
| SCHEMBL7774786 | 0.72 | CHRM2 (0.81) | CYP1A2CYP3A4CYP2D6CYP2C19HDAC1 | |
| SCHEMBL3571060 | 0.72 | HDAC1 (0.62) | CYP1A2CYP3A4CYP2D6CYP2C19HDAC1 |
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-2079525-A1 | CALCIUM RECEPTOR MODULATING AGENTS | Amgen Inc. (US) | 2009-07-22 | — | — | EP | disclosed |
| WO-2008057282-A1 | CALCIUM RECEPTOR MODULATING AGENTS | AMGEN INC. (US) | 2008-05-15 | — | — | WO | disclosed |