Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 4/20 | 0.42 |
| ▸ | IRS1 | P35568 | 3/20 | 0.42 |
| ▸ | GAB1 | Q13480 | 3/20 | 0.42 |
| ▸ | ADAM17 | P78536 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | GHSR | Q92847 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL979271 | 0.92 | AKT1 (0.47) | AKT1IRS1GAB1ADAM17LMNA | |
| SCHEMBL978076 | 0.85 | AKT1 (0.49) | AKT1IRS1GAB1LMNACA2 | |
| SCHEMBL978720 | 0.83 | AKT1 (0.48) | AKT1IRS1GAB1ADAM17LMNA | |
| SCHEMBL980126 | 0.80 | AKT1 (0.46) | AKT1IRS1GAB1LMNACA2 | |
| SCHEMBL4508805 | 0.78 | AKT1 (0.39) | AKT1IRS1GAB1ADAM17LMNA | |
| SCHEMBL979272 | 0.78 | AKT1 (0.46) | AKT1IRS1GAB1ADAM17LMNA | |
| SCHEMBL979858 | 0.77 | AKT1 (0.47) | AKT1IRS1GAB1ADAM17LMNA | |
| SCHEMBL979832 | 0.77 | LMNA (0.45) | AKT1IRS1GAB1ADAM17LMNA | |
| Iodide SCHEMBL980308 | 0.77 | AKT1 (0.46) | AKT1IRS1GAB1LMNAALDH1A1 | |
| Iodide SCHEMBL978749 | 0.76 | AKT1 (0.48) | AKT1IRS1GAB1LMNAALDH1A1 |
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-2009015485-A1 | CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER | UNIVERSITY HEALTH NETWORK (CA) | 2009-02-05 | — | — | WO | disclosed |