Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 2/20 | 1.00 |
| ▸ | MTOR | P42345 | 1/20 | 1.00 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | ALPG | P10696 | 1/20 | 0.44 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ITPR3 | Q14573 | 5/20 | 0.41 |
| ▸ | CETP | P11597 | 3/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | ITPR2 | Q14571 | 1/20 | 0.39 |
| ▸ | ITPR1 | Q14643 | 1/20 | 0.39 |
| ▸ | INPPL1 | O15357 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL8574542 | 1.00 | PDPK1 (1.00) | PDPK1MTORTSHRALPGPTK2B | |
| SCHEMBL5865737 | 0.90 | PDPK1 (0.82) | PDPK1MTORTSHRITPR3ITPR2 | |
| SCHEMBL5865550 | 0.90 | PDPK1 (0.82) | PDPK1MTORTSHRITPR3ITPR2 | |
| SCHEMBL14094690 | 0.84 | PDPK1 (0.73) | PDPK1MTORTSHRALPGPTK2B | |
| SCHEMBL13109619 | 0.81 | PDPK1 (0.68) | PDPK1MTORTSHRNPC1RAB9A | |
| SCHEMBL9299791 | 0.80 | PDPK1 (0.65) | PDPK1MTORTSHRALDH1A1CETP | |
| SCHEMBL9301165 | 0.80 | PDPK1 (0.65) | PDPK1MTORTSHRALDH1A1CETP | |
| SCHEMBL5830234 | 0.79 | PDPK1 (0.65) | PDPK1MTORTSHRALPGPTK2B | |
| SCHEMBL7720528 | 0.79 | PDPK1 (0.65) | PDPK1MTORTSHRALPGPTK2B | |
| SCHEMBL13109573 | 0.79 | PDPK1 (0.65) | PDPK1MTORTSHRALPGPTK2B |
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-2011064559-A2 | NOVEL INOSITOL PHOSPHATE DERIVATIVES | QUEEN MARY AND WESTFIELD COLLEGE, UNIVERSITY OF LONDON (GB) | 2011-06-03 | — | — | WO | disclosed |