Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL16806287 | 0.84 | IGF1R (0.32) | ERN1 | |
| SCHEMBL2673044 | 0.72 | TSHR (0.39) | ALDH1A1TSHRLMNAMEN1KMT2A | |
| SCHEMBL6342720 | 0.71 | PKM (0.34) | ERN1 | |
| SCHEMBL31539853 | 0.71 | LMNA (0.40) | ALDH1A1TSHRLMNAMEN1KMT2A | |
| SCHEMBL14853024 | 0.71 | LMNA (0.40) | ALDH1A1TSHRLMNAMEN1KMT2A | |
| SCHEMBL29046691 | 0.69 | ALDH1A1 (0.45) | ALDH1A1TSHRLMNAMEN1KMT2A | |
| SCHEMBL15725739 | 0.68 | ERN1 (0.30) | ERN1 | |
| SCHEMBL9839299 | 0.68 | KDM4E (0.33) | ALDH1A1KMT2A | |
| SCHEMBL14703277 | 0.67 | ERN1 (0.33) | ERN1PRKDC | |
| SCHEMBL6335694 | 0.67 | ALDH1A1 (0.37) | ALDH1A1LMNAERN1TDP1 |
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-2007089031-A1 | PIPERIDINE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-08-09 | — | — | WO | disclosed |