Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 7/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 2/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11947321 | 0.90 | KCNH2 (0.50) | TAAR1HRH3ALDH1A1MEN1TP53 | |
| SCHEMBL21419317 | 0.82 | ALDH1A1 (0.55) | TAAR1HRH3ALDH1A1CYP1A2MAPT | |
| SCHEMBL19767102 | 0.80 | CNR1 (0.41) | TP53 | |
| SCHEMBL25833598 | 0.80 | TAAR1 (0.61) | TAAR1HRH3ALDH1A1MEN1TP53 | |
| SCHEMBL11712049 | 0.79 | MEN1 (0.40) | MEN1KMT2A | |
| SCHEMBL18800289 | 0.76 | PDE2A (0.41) | TAAR1ALDH1A1CYP1A2MAPTLMNA | |
| SCHEMBL12085752 | 0.76 | KIF11 (0.37) | ALDH1A1CYP1A2MAPT | |
| SCHEMBL20081762 | 0.75 | TAAR1 (0.55) | TAAR1HRH3ALDH1A1MEN1TP53 | |
| SCHEMBL29204036 | 0.75 | TAAR1 (0.55) | TAAR1HRH3TSHR | |
| SCHEMBL24595024 | 0.75 | SLC6A2 (0.39) | — |
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-8232273-B2 | Heterocyclic compounds and methods of use | GENENTECH, INC. (US) | 2012-07-31 | — | — | US | disclosed |