Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15054977 | 0.97 | MEN1 (0.48) | SLC6A4MEN1KMT2ANPSR1CYP1A2 | |
| SCHEMBL15054845 | 0.94 | KDM1A (0.47) | SLC6A4MEN1KMT2ANPSR1KDM1A | |
| SCHEMBL6676255 | 0.83 | AKR1C1 (0.53) | MEN1KMT2ANPSR1CYP1A2CYP2C19 | |
| SCHEMBL3227451 | 0.83 | MEN1 (0.58) | MEN1KMT2ANPSR1CYP1A2CYP2C19 | |
| SCHEMBL8097387 | 0.82 | ALDH1A1 (0.50) | MEN1KMT2ANPSR1CYP1A2CYP2C19 | |
| SCHEMBL6676866 | 0.80 | AKR1C1 (0.57) | MEN1KMT2ANPSR1CYP1A2CYP2C19 | |
| SCHEMBL27256555 | 0.79 | NPSR1 (0.46) | SLC6A4MEN1KMT2ANPSR1CYP1A2 | |
| SCHEMBL6674979 | 0.79 | AKR1C1 (0.56) | MEN1KMT2ANPSR1CYP1A2CYP2C19 | |
| SCHEMBL2847573 | 0.79 | HDAC4 (0.46) | SLC6A4SLC6A2 | |
| SCHEMBL30492221 | 0.78 | KDM1A (0.50) | MEN1KMT2ANPSR1CYP1A2CYP2C19 |
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-2013096151-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2013-06-27 | — | — | WO | disclosed |