Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.35 |
| ▸ | IGF1R | P08069 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.31 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | PREP | P48147 | 1/20 | 0.31 |
| ▸ | FAP | Q12884 | 1/20 | 0.31 |
| ▸ | SLC40A1 | Q9NP59 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2189562 | 0.88 | TRPV1 (0.40) | TRPV1IGF1RALDH1A1THRBMAPT | |
| SCHEMBL5668846 | 0.79 | IGF1R (0.47) | IGF1RMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2172634 | 0.78 | TRPV1 (0.56) | TRPV1IGF1RMAPTCYP1A2CYP3A4 | |
| SCHEMBL2189359 | 0.74 | CNR1 (0.33) | TRPV1ALDH1A1MAPTTP53 | |
| SCHEMBL2175901 | 0.72 | SCN2A (0.47) | TRPV1IGF1RMAPTCYP1A2CYP3A4 | |
| SCHEMBL2186614 | 0.71 | TRPV1 (0.40) | TRPV1IGF1RMAPTCYP1A2CYP3A4 | |
| SCHEMBL4387635 | 0.70 | SGMS1 (0.47) | TRPV1ALDH1A1THRBMAPTCYP1A2 | |
| SCHEMBL2172869 | 0.70 | CYP1A2 (0.43) | TRPV1ALDH1A1MAPTCYP1A2CYP3A4 | |
| SCHEMBL4390454 | 0.70 | MAPT (0.46) | TRPV1ALDH1A1MAPTCYP1A2CYP3A4 | |
| SCHEMBL4392420 | 0.70 | CYP1A2 (0.52) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 |
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 |