Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | LIPE | Q05469 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | NPC1L1 | Q9UHC9 | 2/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | CKS1B | P61024 | 1/20 | 0.34 |
| ▸ | SKP1 | P63208 | 1/20 | 0.34 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2174028 | 0.90 | CHRM2 (0.37) | CHRM2LIPEADORA2AADORA2BKDM5A | |
| SCHEMBL5669978 | 0.84 | CHRM2 (0.43) | CHRM2LIPEMCHR1SMN1; SMN2TP53 | |
| SCHEMBL2174258 | 0.76 | MCHR1 (0.40) | MCHR1 | |
| SCHEMBL5668886 | 0.75 | KMT2A (0.41) | MCHR1EPHX2 | |
| SCHEMBL2173319 | 0.75 | MCHR1 (0.40) | MCHR1 | |
| SCHEMBL4387610 | 0.74 | KDM4E (0.42) | CHRM2MCHR1EPHX2SMN1; SMN2 | |
| SCHEMBL4389385 | 0.73 | TAOK1 (0.43) | MCHR1NAMPT | |
| SCHEMBL4392436 | 0.73 | POLB (0.53) | CHRM2MCHR1EPHX2CHRM4 | |
| SCHEMBL5668976 | 0.72 | LMNA (0.43) | MCHR1EPHX2SMN1; SMN2 | |
| SCHEMBL5668246 | 0.72 | L3MBTL1 (0.49) | NAMPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7973061-B2 | Anaplastic lymphoma kinase modulators and methods of use | EXELIXIS, INC. (US) | 2011-07-05 | — | — | US | claimed |