Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 2/20 | 0.55 |
| ▸ | MTOR | P42345 | 1/20 | 0.55 |
| ▸ | BCHE | P06276 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.42 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3315432 | 1.00 | PDPK1 (0.55) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL6577368 | 1.00 | PDPK1 (0.55) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL9455955 | 0.98 | PDPK1 (0.53) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL10678791 | 0.98 | PDPK1 (0.53) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL7921748 | 0.98 | PDPK1 (0.56) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL4350755 | 0.98 | PDPK1 (0.56) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL10372399 | 0.96 | PDPK1 (0.55) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL4865025 | 0.94 | PDPK1 (0.53) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL9294599 | 0.94 | PDPK1 (0.58) | PDPK1MTORBCHETSHRSLC6A2 | |
| SCHEMBL8194117 | 0.94 | PDPK1 (0.53) | PDPK1MTORBCHETSHRSLC6A2 |
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 |