Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.36 |
| ▸ | TACR1 | P25103 | 4/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.34 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19798405 | 0.77 | EPHX2 (0.50) | EPHX2PDPK1MTORBCHETACR1 | |
| SCHEMBL14344813 | 0.76 | LGALS9 (0.43) | HSD11B1 | |
| SCHEMBL14365413 | 0.73 | GBA1 (0.37) | GBA1 | |
| SCHEMBL14344817 | 0.73 | EPHX2 (0.37) | EPHX2PDPK1MTORBCHETACR1 | |
| SCHEMBL25084017 | 0.73 | BCHE (0.47) | PDPK1MTORPDE4DSLC6A2BCHE | |
| SCHEMBL371547 | 0.71 | PDPK1 (0.45) | PDPK1MTORPDE4DSLC6A2BCHE | |
| SCHEMBL371489 | 0.71 | PDPK1 (0.45) | PDPK1MTORPDE4DSLC6A2BCHE | |
| SCHEMBL371490 | 0.71 | PDPK1 (0.45) | PDPK1MTORPDE4DSLC6A2BCHE | |
| SCHEMBL371546 | 0.71 | PDPK1 (0.45) | PDPK1MTORPDE4DSLC6A2BCHE | |
| SCHEMBL21570654 | 0.71 | CTSL (0.46) | EPHX2PDPK1MTOR |
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 |
|---|---|---|---|---|---|---|---|
| US-7312240-B2 | Conformationally constrained paclitaxel analogs and their use as anticancer and anti-Alzheimers agents | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 2007-12-25 | — | — | US | disclosed |