Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 7/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7539080 | 0.98 | LMNA (0.46) | SMN1; SMN2LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL2582810 | 0.94 | ALDH1A1 (0.42) | SMN1; SMN2LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL3042455 | 0.87 | TSHR (0.44) | SMN1; SMN2LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL8161878 | 0.87 | CA1 (0.33) | ALDH1A1MEN1KMT2ATSHRTHRB | |
| Fluoride SCHEMBL27902336 | 0.85 | ALDH1A1 (0.32) | ALDH1A1MEN1KMT2ATSHRTHRB | |
| SCHEMBL15292867 | 0.84 | ADRB2 (0.38) | SMN1; SMN2LMNAALDH1A1TSHR | |
| SCHEMBL10030120 | 0.82 | — | — | |
| Fluoride SCHEMBL28805747 | 0.82 | ADRB2 (0.36) | SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL15984917 | 0.82 | CA1 (0.33) | ALDH1A1MEN1KMT2ATSHRTHRB | |
| SCHEMBL3482445 | 0.80 | ADRB2 (0.32) | LMNATSHR |
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-1997046525-A1 | 5-ALKOXY-TRYPTAMINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS 5-HT1D RECEPTOR AGONISTS | ALLELIX BIOPHARMACEUTICALS INC. (CA) | 1997-12-11 | — | — | WO | disclosed |