Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 3/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | PREP | P48147 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042800 | 0.83 | CNR1 (0.45) | SMN1; SMN2TSHRLMNANR4A1GBA1 | |
| SCHEMBL20042806 | 0.83 | CNR1 (0.47) | SMN1; SMN2TSHRLMNANR4A1GBA1 | |
| SCHEMBL20042764 | 0.82 | CNR1 (0.49) | SMN1; SMN2TSHRLMNANR4A1GBA1 | |
| SCHEMBL20042660 | 0.81 | CNR1 (0.39) | SMN1; SMN2TSHRLMNANR4A1GBA1 | |
| SCHEMBL20042816 | 0.81 | CNR1 (0.45) | SMN1; SMN2TSHRLMNANR4A1GBA1 | |
| SCHEMBL20042793 | 0.81 | SMN1; SMN2 (0.37) | SMN1; SMN2TSHRLMNANR4A1GBA1 | |
| SCHEMBL20042669 | 0.80 | AR (0.48) | TSHRLMNAPREPMEN1KMT2A | |
| SCHEMBL20042706 | 0.80 | ALDH1A1 (0.43) | SMN1; SMN2TSHRLMNANR4A1ALDH1A1 | |
| SCHEMBL20042839 | 0.79 | P2RX7 (0.45) | SMN1; SMN2TSHRGBA1P2RX7MEN1 | |
| SCHEMBL20042779 | 0.79 | GPR55 (0.39) | SMN1; SMN2TSHRLMNANR4A1GBA1 |
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-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |