Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TACR1 | P25103 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL19982457 | 0.91 | ALDH1A1 (0.32) | ALDH1A1KMT2AMEN1LMNAHPGD | |
| SCHEMBL19982409 | 0.76 | KDM4E (0.32) | ALDH1A1KMT2AMEN1LMNAKDM4E | |
| SCHEMBL19982576 | 0.76 | — | — | |
| SCHEMBL19982407 | 0.74 | MAPT (0.36) | ALDH1A1KMT2AMEN1LMNAKDM4E | |
| SCHEMBL19970488 | 0.74 | PTPRC (0.36) | ALDH1A1KMT2ALMNATHRBHPGD | |
| SCHEMBL19970483 | 0.74 | PTPRC (0.36) | ALDH1A1KMT2ALMNATHRBHPGD | |
| SCHEMBL19982456 | 0.71 | TLR4 (0.39) | LMNA | |
| SCHEMBL19982454 | 0.71 | TLR4 (0.39) | LMNA | |
| SCHEMBL19970531 | 0.68 | ALDH1A1 (0.33) | ALDH1A1KMT2AMEN1LMNAKDM4E | |
| SCHEMBL19982563 | 0.64 | TLR4 (0.37) | LMNA |
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-3296296-A1 | CYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-03-21 | — | — | EP | disclosed |