Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | ALPL | P05186 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | ALPI | P09923 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 4/20 | 0.38 |
| ▸ | NOS1 | P29475 | 2/20 | 0.38 |
| ▸ | NOS3 | P29474 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6973667 | 0.83 | HDAC3 (0.37) | TAAR1CYP1A2CYP2D6ALPLKCNH2 | |
| SCHEMBL6977315 | 0.83 | KDM1A (0.39) | NOS2NOS3KDM1AHTR2CSLC6A2 | |
| SCHEMBL6975809 | 0.82 | ALPL (0.38) | TAAR1CYP1A2CYP2D6ALPLKCNH2 | |
| SCHEMBL6976343 | 0.78 | ALPL (0.36) | TAAR1CYP1A2CYP2D6ALPLKCNH2 | |
| SCHEMBL6976811 | 0.77 | ALPL (0.35) | TAAR1CYP1A2CYP2D6ALPLKCNH2 | |
| SCHEMBL6257456 | 0.76 | TAAR1 (0.47) | TAAR1CYP1A2CYP2D6ALPLKCNH2 | |
| SCHEMBL6254235 | 0.76 | TAAR1 (0.47) | TAAR1CYP1A2CYP2D6ALPLKCNH2 | |
| Hydrochloric Acid SCHEMBL7561980 | 0.74 | NOS2 (0.46) | TAAR1CYP1A2CYP2D6ALPLKCNH2 | |
| SCHEMBL6977066 | 0.72 | HDAC3 (0.46) | LMNAALDH1A1HDAC3NCOR1HDAC2 | |
| SCHEMBL6912342 | 0.72 | CYP1A2 (0.41) | TAAR1CYP1A2CYP2D6ALPLKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011088181-A1 | COMPOUNDS AND METHODS | TEMPERO PHARMACEUTICALS, INC. (US) | 2011-07-21 | — | — | WO | disclosed |