Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 6/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | STAT6 | P42226 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | CCR2 | P41597 | 1/20 | 0.31 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7230380 | 0.98 | SIGMAR1 (0.37) | CHRM5CHRM3CXCR4SIGMAR1GAA | |
| SCHEMBL7225311 | 0.92 | CHRM5 (0.39) | CHRM5CHRM3CXCR4SIGMAR1ALDH1A1 | |
| SCHEMBL7223824 | 0.92 | CHRM5 (0.33) | CHRM5CHRM3CXCR4SIGMAR1ALDH1A1 | |
| SCHEMBL7694509 | 0.90 | CHRM5 (0.44) | CHRM5CHRM3CXCR4SIGMAR1GAA | |
| SCHEMBL7222004 | 0.88 | SIGMAR1 (0.43) | CHRM5CHRM3CXCR4SIGMAR1GAA | |
| SCHEMBL7224032 | 0.83 | KDM4E (0.40) | CHRM5CHRM3ALDH1A1SMN1; SMN2 | |
| SCHEMBL7222024 | 0.83 | CHRM5 (0.44) | CHRM5CHRM3CXCR4SIGMAR1ALDH1A1 | |
| SCHEMBL7228369 | 0.80 | ALDH1A1 (0.46) | GAAALDH1A1STAT6SMN1; SMN2MEN1 | |
| SCHEMBL7229675 | 0.79 | CHRM5 (0.38) | CHRM5CHRM3CXCR4SIGMAR1GAA | |
| SCHEMBL7229670 | 0.79 | CHRM5 (0.38) | CHRM5CHRM3CXCR4SIGMAR1GAA |
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 |