Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 2/20 | 0.50 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.50 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.50 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | NPY1R | P25929 | 1/20 | 0.47 |
| ▸ | NPY2R | P49146 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | BCL6 | P41182 | 1/20 | 0.47 |
| ▸ | BCOR | Q6W2J9 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16148312 | 0.89 | PDK1 (0.52) | PDK1PDK2PDK3PDK4SMN1; SMN2 | |
| SCHEMBL16148870 | 0.88 | MDH1 (0.47) | PDK1PDK2PDK3PDK4SMN1; SMN2 | |
| SCHEMBL16147786 | 0.86 | CA1 (0.48) | SMN1; SMN2ALDH1A1LMNAKDM4EMAPT | |
| SCHEMBL16148498 | 0.83 | BCL6 (0.50) | PDK1PDK2PDK3PDK4SMN1; SMN2 | |
| SCHEMBL16148223 | 0.83 | NOTUM (0.47) | PDK1PDK2PDK3PDK4SMN1; SMN2 | |
| SCHEMBL16148950 | 0.82 | ACLY (0.49) | PDK1PDK2PDK3PDK4SMN1; SMN2 | |
| SCHEMBL16147742 | 0.82 | ALDH1A1 (0.56) | PDK1PDK2PDK3PDK4SMN1; SMN2 | |
| SCHEMBL16147540 | 0.81 | CA12 (0.43) | PDK1PDK2PDK3PDK4SMN1; SMN2 | |
| SCHEMBL16148132 | 0.79 | EGFR (0.55) | SMN1; SMN2LMNAKDM4EMAPTRAB9A | |
| SCHEMBL16148623 | 0.75 | HTT (0.55) | SMN1; SMN2ALDH1A1LMNAKDM4EMAPT |
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 |