Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19908556 | 0.84 | TSHR (0.41) | KDM4EALDH1A1MAPTTP53CYP3A4 | |
| SCHEMBL23469354 | 0.81 | CYP3A4 (0.41) | ALDH1A1MAPTTP53CYP3A4TSHR | |
| SCHEMBL23469259 | 0.78 | SRC (0.33) | CNR2KDM4EALDH1A1ARSMN1; SMN2 | |
| SCHEMBL3636751 | 0.73 | RAPGEF4 (0.41) | KDM4EALDH1A1MAPTTSHRTDP1 | |
| SCHEMBL3634658 | 0.73 | TDP1 (0.45) | CNR2ALDH1A1MAPTTP53CYP3A4 | |
| SCHEMBL1136253 | 0.73 | MAPT (0.50) | KDM4EMAPTIDO1GAALMNA | |
| SCHEMBL22743893 | 0.73 | TLR8 (0.31) | ALDH1A1MAPTARSMN1; SMN2IDO1 | |
| SCHEMBL27847023 | 0.73 | TSHR (0.41) | KDM4EALDH1A1MAPTCYP3A4TSHR | |
| SCHEMBL12963494 | 0.73 | RAPGEF4 (0.50) | ALDH1A1MAPTTSHRTDP1RAPGEF4 | |
| SCHEMBL18299077 | 0.73 | KDM4E (0.42) | KDM4EALDH1A1MAPTTP53CYP3A4 |
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-3287441-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |