Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.44 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | ACLY | P53396 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | SLC16A3 | O15427 | 2/20 | 0.39 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL27667657 | 0.80 | RORC (0.56) | KMT2ARAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27701570 | 0.79 | SLC16A3 (0.43) | ALOX15RAB9ARXFP1SLC16A3CYP1A2 | |
| SCHEMBL24460157 | 0.73 | MEN1 (0.55) | PDK1PDK2PDK3PDK4ALOX15 | |
| SCHEMBL30742579 | 0.71 | TRPV1 (0.56) | KMT2ARAB9ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL14885885 | 0.71 | TMPRSS4 (0.70) | PDK1PDK2PDK3PDK4KMT2A | |
| SCHEMBL30771735 | 0.71 | TMPRSS4 (0.70) | PDK1PDK2PDK3PDK4KMT2A | |
| SCHEMBL678335 | 0.70 | MAPT (0.46) | — | |
| SCHEMBL29617490 | 0.70 | GRM5 (0.56) | PDK1PDK2PDK3PDK4KMT2A | |
| SCHEMBL24460229 | 0.70 | GRM5 (0.56) | PDK1PDK2PDK3PDK4KMT2A | |
| SCHEMBL7686835 | 0.70 | EGLN1 (0.69) | KMT2AMEN1ALDH1A1 |
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-2014165816-A1 | COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME | NORTH CAROLINA CENTRAL UNIVERSITY (US) | 2014-10-09 | — | — | WO | disclosed |