Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 7/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11955054 | 0.81 | HRH3 (0.43) | TAAR1HRH3ALDH1A1KDM4EMEN1 | |
| SCHEMBL15495007 | 0.81 | CNR1 (0.44) | TP53MAPTBACE1 | |
| SCHEMBL25833598 | 0.81 | TAAR1 (0.61) | TAAR1HRH3ALDH1A1MEN1TP53 | |
| SCHEMBL23954004 | 0.80 | HRH3 (0.48) | TAAR1HRH3ALDH1A1HTR1AHTR1D | |
| SCHEMBL24648925 | 0.79 | BACE1 (0.59) | TAAR1ALDH1A1KDM4EHTR1ATP53 | |
| SCHEMBL10240551 | 0.78 | TRPA1 (0.43) | TAAR1ALDH1A1KDM4EHTR1AHTR1D | |
| SCHEMBL23644200 | 0.78 | SKP2 (0.46) | ALDH1A1HTR1ABACE1 | |
| SCHEMBL20081762 | 0.76 | TAAR1 (0.55) | TAAR1HRH3ALDH1A1NOS3NOS1 | |
| SCHEMBL29204036 | 0.76 | TAAR1 (0.55) | TAAR1HRH3KDM4EHTR1A | |
| SCHEMBL22869152 | 0.75 | HRH3 (0.47) | TAAR1HRH3ALDH1A1HTR1AHTR1D |
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 |