Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.47 |
| ▸ | LMNA | P02545 | 7/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.40 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | MLYCD | O95822 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3111992 | 0.89 | SPHK2 (0.45) | SMN1; SMN2ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL5248793 | 0.88 | ALDH1A1 (0.40) | SMN1; SMN2LMNAALDH1A1HTTMEN1 | |
| SCHEMBL5245700 | 0.87 | HDAC4 (0.40) | SMN1; SMN2ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL3113582 | 0.87 | HPGD (0.42) | SMN1; SMN2LMNAALDH1A1KDM4EHTT | |
| SCHEMBL5250048 | 0.87 | EPHX2 (0.46) | SMN1; SMN2LMNAMEN1KMT2AHPGD | |
| Trifluoroacetic Acid SCHEMBL5245904 | 0.85 | NPSR1 (0.33) | SMN1; SMN2LMNAALDH1A1MAPTKDM4E | |
| SCHEMBL3107164 | 0.84 | MEN1 (0.40) | SMN1; SMN2ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL3113152 | 0.84 | SLC6A5 (0.42) | LMNAMEN1KMT2A | |
| SCHEMBL5248051 | 0.84 | ABCB1 (0.46) | SMN1; SMN2LMNAMEN1KMT2ANPC1 | |
| SCHEMBL5244893 | 0.83 | MAPK14 (0.48) | — |
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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |