Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | STAT6 | P42226 | 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 | |
|---|---|---|---|---|
| SCHEMBL7230894 | 0.96 | CHRM5 (0.41) | CHRM5CHRM3SIGMAR1SMN1; SMN2ALDH1A1 | |
| SCHEMBL7230900 | 0.96 | CHRM5 (0.41) | CHRM5CHRM3SIGMAR1SMN1; SMN2ALDH1A1 | |
| SCHEMBL7229670 | 0.91 | CHRM5 (0.38) | CHRM5CHRM3SIGMAR1ALDH1A1 | |
| SCHEMBL7229675 | 0.91 | CHRM5 (0.38) | CHRM5CHRM3SIGMAR1ALDH1A1 | |
| SCHEMBL7710764 | 0.90 | CHRM5 (0.33) | CHRM5CHRM3SIGMAR1 | |
| SCHEMBL7708079 | 0.90 | CHRM5 (0.33) | CHRM5CHRM3SIGMAR1 | |
| SCHEMBL7708083 | 0.90 | CHRM5 (0.33) | CHRM5CHRM3SIGMAR1 | |
| SCHEMBL7223188 | 0.88 | KDM4E (0.38) | CHRM5CHRM3SIGMAR1SMN1; SMN2ALDH1A1 | |
| SCHEMBL7223180 | 0.88 | KDM4E (0.38) | CHRM5CHRM3SIGMAR1SMN1; SMN2ALDH1A1 | |
| SCHEMBL7223190 | 0.88 | KDM4E (0.38) | CHRM5CHRM3SIGMAR1SMN1; SMN2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6552226-B1 | Rapid; low temperature; one pot synthesis; reduced catalytic quantities of such as lewis acid and tertiary amine; entiomerically pure products | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2003-04-22 | — | — | US | disclosed |
| WO-2002026683-A1 | TANDEM ACYL-CLAISEN REARRANGEMENT IN THE PREPARATION OF CHIRAL PRODUCTS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2002-04-04 | — | — | WO | disclosed |