Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 5/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1824155 | 0.88 | KDM4E (0.42) | CHEK1ACHEKDM4EMEN1ALDH1A1 | |
| SCHEMBL1615904 | 0.86 | GAA (0.43) | GAACHEK1ACHEBCHEMAOA | |
| SCHEMBL1825695 | 0.86 | PARP1 (0.44) | GAACHEK1KDM4EALDH1A1MAPT | |
| SCHEMBL1824756 | 0.86 | CXCR4 (0.41) | CHEK1SIGMAR1KDM4EMEN1ALDH1A1 | |
| SCHEMBL1823170 | 0.84 | SPHK2 (0.43) | MCHR1 | |
| SCHEMBL1828535 | 0.83 | GAA (0.47) | GAAKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL1826204 | 0.82 | MCHR2 (0.38) | KDM4EMEN1ALDH1A1MAPTHTT | |
| SCHEMBL1823810 | 0.82 | ALDH1A1 (0.43) | GAAKDM4EMEN1ALDH1A1HTT | |
| SCHEMBL1826566 | 0.82 | DRD4 (0.44) | GAAKDM4EALDH1A1MAPTHTT | |
| SCHEMBL1821784 | 0.82 | FAAH (0.37) | KDM4EALDH1A1MAPT |
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-1794122-B1 | 3-SUBSTITUTED-5- AND 6-AMINOALKYL INDOLE-2-CARBOXYLIC ACID AMIDES AND RELATED ANALOGS AS INHIBITORS OF CASEIN KINASE I | AVENTIS PHARMA INC (US) | 2011-05-04 | — | — | EP | claimed |