Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 4/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.31 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | GOT1 | P17174 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | RBP4 | P02753 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20141537 | 0.74 | KEAP1 (0.47) | KEAP1PDPK1BCHEGOT1GAA | |
| SCHEMBL20142570 | 0.72 | KEAP1 (0.38) | KEAP1PDPK1BCHENR3C1PGR | |
| SCHEMBL30885785 | 0.71 | IDO1 (0.48) | BCHEIDO1BACE1MAPT | |
| SCHEMBL5205461 | 0.71 | IDO1 (0.48) | BCHEIDO1BACE1MAPT | |
| SCHEMBL20140928 | 0.70 | SLC6A7 (0.42) | GAAMAPT | |
| SCHEMBL20142085 | 0.69 | KLKB1 (0.30) | — | |
| SCHEMBL25267550 | 0.68 | MEN1 (0.36) | KEAP1IDO1PTPN11GAAMAPT | |
| SCHEMBL3296720 | 0.68 | GOT1 (0.42) | KEAP1PDPK1BCHEGOT1GAA | |
| SCHEMBL3624025 | 0.67 | AR (0.51) | ARGAAMAPT | |
| Trifluoroacetic Acid SCHEMBL30839779 | 0.67 | BACE1 (0.46) | KEAP1BACE1HTR6 |
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-2018089493-A1 | PYRROLE mTORC INHIBITORS AND USES THEREOF | NAVITOR PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |