Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.58 |
| ▸ | GRM5 | P41594 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14249290 | 0.80 | HDAC6 (0.55) | HDAC6GRM5 | |
| SCHEMBL9121077 | 0.76 | GRM5 (0.51) | HDAC6GRM5HPGDUSP2ALDH1A1 | |
| SCHEMBL14248903 | 0.75 | ALDH1A1 (0.42) | HDAC6HPGDUSP2ALDH1A1MEN1 | |
| SCHEMBL12210556 | 0.74 | HDAC6 (1.00) | HDAC6GRM5HPGDHDAC3HDAC1 | |
| SCHEMBL14249716 | 0.74 | RIPK1 (0.39) | HDAC6HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL252026 | 0.72 | HPGD (0.79) | HPGDUSP2ALDH1A1SIGMAR1MEN1 | |
| SCHEMBL7129676 | 0.72 | HPGD (0.79) | HPGDUSP2ALDH1A1SIGMAR1MEN1 | |
| Hydrochloric Acid SCHEMBL1597472 | 0.70 | HPGD (0.76) | HPGDUSP2ALDH1A1SIGMAR1MEN1 | |
| SCHEMBL20084000 | 0.68 | HPGD (0.66) | HPGDUSP2ALDH1A1SIGMAR1MEN1 | |
| SCHEMBL17281611 | 0.68 | ALDH1A1 (0.54) | HPGDUSP2ALDH1A1SIGMAR1BLM |
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-2012172093-A1 | DIHYDROINDOLIZINE DERIVATE AS METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2012-12-20 | — | — | WO | disclosed |