Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29379963 | 0.78 | CA2 (0.56) | CA2MEN1ALDH1A1KMT2ADNMT1 | |
| SCHEMBL23500126 | 0.78 | PSMB8 (0.38) | CA2MEN1ALDH1A1KMT2AMCL1 | |
| SCHEMBL28134157 | 0.78 | CA2 (0.56) | CA2MEN1ALDH1A1KMT2ADNMT1 | |
| SCHEMBL4806043 | 0.77 | CA2 (0.55) | CA2MEN1ALDH1A1KMT2ADNMT1 | |
| SCHEMBL31125053 | 0.75 | HDAC3 (0.54) | CYP1A2HDAC8HDAC3HDAC4HDAC1 | |
| SCHEMBL23220879 | 0.75 | HDAC3 (0.54) | CYP1A2HDAC8HDAC3HDAC4HDAC1 | |
| SCHEMBL30250636 | 0.74 | CYP2A6 (0.31) | — | |
| SCHEMBL14780084 | 0.74 | CYP2A6 (0.31) | — | |
| SCHEMBL6229401 | 0.73 | NR4A1 (0.44) | CA2MEN1ALDH1A1KMT2AHDAC8 | |
| SCHEMBL28660108 | 0.72 | MGLL (0.53) | CA2MEN1ALDH1A1KMT2ADNMT1 |
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-1537091-B1 | NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMMA AGONISTS | HOFFMANN LA ROCHE (CH) | 2010-10-06 | — | — | EP | disclosed |