Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | FDPS | P14324 | 10/20 | 0.39 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GGPS1 | O95749 | 6/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.34 |
| ▸ | LPAR3 | Q9UBY5 | 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 | |
|---|---|---|---|---|
| Methylene Chloride SCHEMBL4239939 | 0.91 | FDPS (0.38) | TSHRFDPSSMPD1ALDH1A1GGPS1 | |
| SCHEMBL6415042 | 0.78 | — | — | |
| Chloroform SCHEMBL4249292 | 0.77 | TSHR (0.42) | TSHRTHRBFDPSSMPD1ALDH1A1 | |
| Chloroform SCHEMBL14735852 | 0.77 | TSHR (0.42) | TSHRTHRBFDPSSMPD1ALDH1A1 | |
| Chloroform SCHEMBL4592445 | 0.77 | TSHR (0.42) | TSHRTHRBFDPSSMPD1ALDH1A1 | |
| Chloroform SCHEMBL14672704 | 0.77 | TSHR (0.42) | TSHRTHRBFDPSSMPD1ALDH1A1 | |
| Chloroform SCHEMBL1493337 | 0.77 | TSHR (0.42) | TSHRTHRBFDPSSMPD1ALDH1A1 | |
| Chloroform SCHEMBL19469979 | 0.77 | TSHR (0.42) | TSHRTHRBFDPSSMPD1ALDH1A1 | |
| Chloroform SCHEMBL3257950 | 0.77 | TSHR (0.42) | TSHRTHRBFDPSSMPD1ALDH1A1 | |
| Chloroform SCHEMBL14672707 | 0.77 | TSHR (0.42) | TSHRTHRBFDPSSMPD1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0939756-B1 | A PROCESS FOR THE STEREOSELECTIVE REDUCTION OF ALPHA,BETA-UNSATURATED KETONES | CHINOIN GYOGYSZER ES VEGYESZET (HU) | 2003-05-14 | — | — | EP | disclosed |
| US-6482959-B1 | Process for the stereoselective reduction of α,β-unsaturated ketones | Chinoin Gyógyszer és Vegyészeti Termékek Gyára Rt. (HU) | 2002-11-19 | — | — | US | disclosed |