Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.41 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3212426 | 0.99 | CA2 (0.45) | CA2CA9KDM4EHSP90AA1HSP90B1 | |
| SCHEMBL3215576 | 0.90 | SIGMAR1 (0.44) | KDM4EMEN1KMT2ASIGMAR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL3210300 | 0.89 | SIGMAR1 (0.43) | KDM4EMEN1KMT2ASIGMAR1ALDH1A1 | |
| SCHEMBL4714175 | 0.85 | SIGMAR1 (0.44) | KDM4ESIGMAR1ALDH1A1HPGDMAPK1 | |
| SCHEMBL3197204 | 0.80 | CTSD (0.45) | MEN1KMT2ASIGMAR1ALDH1A1CASP1 | |
| SCHEMBL3217277 | 0.80 | KDM4E (0.53) | KDM4EKMT2ASIGMAR1ALDH1A1MAPK1 | |
| SCHEMBL4715614 | 0.79 | CTSD (0.46) | KDM4EMEN1KMT2ASIGMAR1ALDH1A1 | |
| Acetic Acid SCHEMBL3216929 | 0.79 | SIGMAR1 (0.42) | KDM4EMEN1KMT2ASIGMAR1ALDH1A1 | |
| SCHEMBL3214965 | 0.78 | SIGMAR1 (0.48) | MEN1KMT2ASIGMAR1ACHECTSD | |
| SCHEMBL3222976 | 0.78 | CTSD (0.48) | MEN1KMT2ASIGMAR1ALDH1A1BCHE |
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-1917245-A1 | HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS | Abbott GmbH & Co. KG (DE) | 2008-05-07 | — | — | EP | disclosed |
| WO-2007022946-A1 | HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS | ABBOTT GMBH & CO. KG (DE) | 2007-03-01 | — | — | WO | disclosed |