Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 16/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL2123215 | 0.93 | HDAC6 (0.41) | HDAC6ALDH1A1DPP4DPP8HDAC8 | |
| SCHEMBL19638457 | 0.81 | CAMK2A (0.47) | DPP4DPP8ESR1 | |
| SCHEMBL3657289 | 0.80 | MTNR1B (0.37) | HDAC6ALDH1A1HDAC1 | |
| SCHEMBL2984099 | 0.79 | DPP4 (0.38) | ALDH1A1DPP4DPP8 | |
| SCHEMBL4639207 | 0.79 | BRD4 (0.42) | ALDH1A1DPP4DPP8HSD11B1CYP2C19 | |
| SCHEMBL3664186 | 0.76 | DPP4 (0.42) | HDAC6DPP4DPP8HDAC8HDAC1 | |
| SCHEMBL2122647 | 0.76 | HDAC6 (0.42) | HDAC6HDAC8ESR1HDAC1HDAC3 | |
| SCHEMBL2123936 | 0.73 | CAMK2A (0.43) | DPP4DPP8ESR1 | |
| SCHEMBL31546529 | 0.73 | CAMK2A (0.43) | DPP4DPP8ESR1 | |
| SCHEMBL2126327 | 0.73 | PKM (0.32) | — |
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-2222669-A1 | OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) | Glaxo Group Limited (GB) | 2010-09-01 | — | — | EP | disclosed |
| WO-2009080725-A1 | OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) | GLAXO GROUP LIMITED (GB) | 2009-07-02 | — | — | WO | disclosed |