Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 8/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12203758 | 0.89 | SMN1; SMN2 (0.37) | CYP1A2HDAC1HDAC6KDM4ECYP3A4 | |
| SCHEMBL12203757 | 0.89 | SMN1; SMN2 (0.37) | CYP1A2HDAC1HDAC6KDM4ECYP3A4 | |
| SCHEMBL12203761 | 0.89 | SMN1; SMN2 (0.37) | CYP1A2HDAC1HDAC6KDM4ECYP3A4 | |
| SCHEMBL7928929 | 0.83 | ERN1 (0.35) | HDAC1HDAC6 | |
| SCHEMBL7928900 | 0.80 | TAAR1 (0.47) | CYP1A2HDAC1HDAC6KDM4E | |
| SCHEMBL7924306 | 0.75 | TAAR1 (0.47) | CYP1A2HDAC1HDAC6KDM4E | |
| SCHEMBL12203754 | 0.74 | KDM4E (0.35) | KDM4EALDH1A1HPGDHSD17B10RAB9A | |
| SCHEMBL7921745 | 0.70 | F2R (0.38) | CYP1A2KDM4EMAPTCYP3A4CYP2C19 | |
| SCHEMBL7917672 | 0.69 | CYP1A2 (0.47) | CYP1A2HDAC1HDAC6KDM4EMAPT | |
| SCHEMBL14803274 | 0.69 | CYP1A2 (0.38) | CYP1A2HDAC1HDAC6KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010042473-A1 | BIARYL SPIROAMINOOXAZOLINE ANALOGUES AS ALPHA2C ADRENERGIC RECEPTOR MODULATORS | SCHERING CORPORATION (US) | 2010-04-15 | — | — | WO | disclosed |