Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 1/20 | 0.56 |
| ▸ | PGR | P06401 | 1/20 | 0.56 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.56 |
| ▸ | AR | P10275 | 1/20 | 0.56 |
| ▸ | AHR | P35869 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 3/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 1/20 | 0.34 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PTPRB | P23467 | 1/20 | 0.34 |
| ▸ | PTPRE | P23469 | 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 | |
|---|---|---|---|---|
| SCHEMBL13085560 | 0.75 | NR3C1 (0.61) | NR3C1PGRNR3C2ARAHR | |
| SCHEMBL2161116 | 0.71 | NR3C1 (1.00) | NR3C1PGRNR3C2ARAHR | |
| SCHEMBL5497010 | 0.71 | PDPK1 (0.57) | NR3C1PGRNR3C2ARAHR | |
| SCHEMBL6091339 | 0.71 | NR3C1 (0.57) | NR3C1PGRNR3C2ARKEAP1 | |
| SCHEMBL30026274 | 0.71 | PDPK1 (0.57) | NR3C1PGRNR3C2ARAHR | |
| SCHEMBL31456523 | 0.71 | NR3C1 (0.57) | NR3C1PGRNR3C2ARKEAP1 | |
| SCHEMBL28940859 | 0.70 | NR3C1 (0.51) | NR3C1PGRNR3C2ARAHR | |
| SCHEMBL21779263 | 0.70 | NR3C1 (0.60) | NR3C1PGRNR3C2ARAHR | |
| SCHEMBL22001247 | 0.70 | NR3C1 (0.56) | NR3C1PGRNR3C2ARAHR | |
| SCHEMBL31668711 | 0.69 | TRPV1 (0.65) | NR3C1PGRNR3C2ARKEAP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2509600-B1 | THERAPEUTICALLY ACTIVE COMPOUNDS FOR USE IN THE TREATMENT OF CANCER CHARACTERIZED AS HAVING AN IDH MUTATION | AGIOS PHARMACEUTICALS INC (US) | 2017-08-02 | — | — | EP | disclosed |