Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.49 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.31 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL3972457 | 0.85 | ALDH1A1 (0.41) | SIGMAR1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL13888890 | 0.81 | SIGMAR1 (0.50) | SIGMAR1CHRM5CHRM3MEN1KMT2A | |
| SCHEMBL8393969 | 0.80 | SIGMAR1 (0.53) | SIGMAR1CHRM5CHRM3MEN1KMT2A | |
| Piperazine SCHEMBL28845954 | 0.78 | SIGMAR1 (0.54) | SIGMAR1CHRM5CHRM3MEN1KMT2A | |
| SCHEMBL13888889 | 0.78 | CHRM5 (0.50) | SIGMAR1CHRM5CHRM3MEN1KMT2A | |
| SCHEMBL8389586 | 0.76 | CHRM5 (0.51) | SIGMAR1CHRM5CHRM3MEN1KMT2A | |
| SCHEMBL5863 | 0.76 | SIGMAR1 (0.56) | SIGMAR1CHRM5CHRM3MEN1KMT2A | |
| SCHEMBL8821394 | 0.75 | SIGMAR1 (0.32) | SIGMAR1 | |
| Hydrochloric Acid SCHEMBL17271878 | 0.74 | ALDH1A1 (0.54) | SIGMAR1CHRM5CHRM3MEN1KMT2A | |
| SCHEMBL12138555 | 0.74 | SIGMAR1 (0.53) | SIGMAR1CHRM5CHRM3MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5874573-A | Compounds with chelation affinity and selectivity for first transition series elements: use in medical therapy | CONCAT, INC. (US) | 1999-02-23 | — | — | US | disclosed |