Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1G | O43497 | 1/20 | 0.44 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.44 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.44 |
| ▸ | SCN10A | Q9Y5Y9 | 4/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.38 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2171264 | 0.87 | NPC1 (0.55) | CACNA1GCACNA1HCACNA1ISCN10ASCN2A | |
| SCHEMBL4388997 | 0.87 | CACNA1G (0.46) | CACNA1GCACNA1HCACNA1ISCN10ASCN2A | |
| SCHEMBL2173835 | 0.84 | NPC1 (0.46) | CACNA1GCACNA1HCACNA1ISCN10ASCN2A | |
| SCHEMBL2171492 | 0.83 | TRPV1 (0.56) | CACNA1GCACNA1HCACNA1ISCN10ASCN2A | |
| SCHEMBL4563131 | 0.82 | MAPT (0.40) | CACNA1GCACNA1HCACNA1ISMN1; SMN2HTT | |
| SCHEMBL5668410 | 0.81 | LTA4H (0.48) | CACNA1GCACNA1HCACNA1ISMN1; SMN2LMNA | |
| SCHEMBL4386435 | 0.80 | CACNA1G (0.43) | CACNA1GCACNA1HCACNA1ITAOK1TAOK3 | |
| SCHEMBL4394082 | 0.80 | CACNA1G (0.43) | CACNA1GCACNA1HCACNA1ITAOK1TAOK3 | |
| SCHEMBL2172285 | 0.80 | CACNA1G (0.45) | CACNA1GCACNA1HCACNA1ISCN10ASMN1; SMN2 | |
| SCHEMBL4384719 | 0.78 | TAOK1 (0.51) | CACNA1GCACNA1HCACNA1ITAOK1TAOK3 |
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-1730128-A1 | ANAPLASTIC LYMPHOMA KINASE MODULATORS AND METHODS OF USE | Exelixis, Inc. (US) | 2006-12-13 | — | — | EP | claimed |
| WO-2005097765-A1 | ANAPLASTIC LYMPHOMA KINASE MODULATORS AND METHODS OF USE | EXELIXIS, INC. (US) | 2005-10-20 | — | — | WO | claimed |