Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.63 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.59 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.38 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.38 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4711520 | 0.98 | SIGMAR1 (0.65) | SIGMAR1CHRM5CHRM3ALDH1A1KMT2A | |
| SCHEMBL14369164 | 0.96 | SIGMAR1 (0.63) | SIGMAR1CHRM5CHRM3ALDH1A1KMT2A | |
| SCHEMBL1905216 | 0.84 | SIGMAR1 (0.71) | SIGMAR1CHRM5CHRM3ALDH1A1KMT2A | |
| SCHEMBL8395095 | 0.83 | SIGMAR1 (0.65) | SIGMAR1CHRM5CHRM3ALDH1A1KMT2A | |
| SCHEMBL10614451 | 0.81 | CHRM5 (0.62) | SIGMAR1CHRM5CHRM3ALDH1A1KMT2A | |
| SCHEMBL1900359 | 0.81 | SIGMAR1 (0.67) | SIGMAR1CHRM5CHRM3ALDH1A1KMT2A | |
| SCHEMBL7862964 | 0.80 | SIGMAR1 (0.61) | SIGMAR1CHRM5CHRM3ALDH1A1GNAI3 | |
| SCHEMBL8023138 | 0.80 | ALDH1A1 (0.67) | SIGMAR1ALDH1A1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL19010425 | 0.80 | ALDH1A1 (0.61) | SIGMAR1CHRM5CHRM3ALDH1A1KMT2A | |
| SCHEMBL10687011 | 0.80 | SIGMAR1 (0.65) | SIGMAR1CHRM5CHRM3ALDH1A1SMN1; SMN2 |
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-0255471-A1 | 1,4,7,10-Tetraazacyclododecane-derivatives | SCHERING AKTIENGESELLSCHAFT (DE) | 1988-02-03 | — | — | EP | claimed |