Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.34 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8843130 | 1.00 | ALDH1A1 (0.44) | ALDH1A1TSHRCHRM5CHRM1CHRM3 | |
| SCHEMBL28489021 | 0.87 | HCAR2 (0.38) | ALDH1A1TSHRCHRM1LMNASMN1; SMN2 | |
| SCHEMBL22588817 | 0.87 | HCAR2 (0.38) | ALDH1A1TSHRCHRM1LMNASMN1; SMN2 | |
| SCHEMBL11683971 | 0.86 | THRB (0.51) | ALDH1A1TSHRTHRBDGKA | |
| SCHEMBL9625355 | 0.86 | ALDH1A1 (0.35) | ALDH1A1TSHRLMNAHSD17B10ALOX15 | |
| SCHEMBL181698 | 0.86 | DGKA (0.44) | ALDH1A1TSHRPGRTHRBDGKA | |
| SCHEMBL9624857 | 0.86 | TSHR (0.33) | ALDH1A1TSHRTHRBDGKA | |
| SCHEMBL21056424 | 0.84 | THRB (0.49) | ALDH1A1TSHRHSD17B10THRBDGKA | |
| SCHEMBL3425071 | 0.84 | THRB (0.37) | ALDH1A1TSHRHSD17B10THRBDGKA | |
| SCHEMBL181838 | 0.84 | NAAA (0.43) | ALDH1A1THRBGAADGKA |
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-0250997-B1 | VALPROIC AND (E)-2-VALPROENOIC ACID DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREFROM | CHIESI FARMACEUTICI S.p.A. (IT) | 1992-04-15 | — | — | EP | claimed |