Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | PRKCA | P17252 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10262639 | 0.89 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| SCHEMBL13300353 | 0.89 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| SCHEMBL14571350 | 0.87 | CYP3A4 (0.40) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| SCHEMBL8201157 | 0.86 | LMNA (0.55) | ALDH1A1LMNATDP1TSHRPRKCA | |
| SCHEMBL8200825 | 0.86 | LMNA (0.55) | ALDH1A1LMNATDP1TSHRPRKCA | |
| SCHEMBL8200830 | 0.86 | LMNA (0.55) | ALDH1A1LMNATDP1TSHRPRKCA | |
| SCHEMBL15542644 | 0.85 | TSHR (0.52) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| SCHEMBL13459987 | 0.84 | TDP1 (0.45) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| SCHEMBL5358516 | 0.84 | TDP1 (0.45) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| SCHEMBL26456198 | 0.83 | ALDH1A1 (0.34) | ALDH1A1LMNAHSD17B10TDP1TSHR |
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-6610638-B1 | Reacting acrolein with alcohols, hydrogenating in presence of catalysts and distillating to recover 3-methoxy-1-propanol, used as cleaning compounds or chemical intermediates | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2003-08-26 | — | — | US | disclosed |
| EP-1085003-A1 | HIGH-PURITY 1,3-PROPANEDIOL DERIVATIVE SOLVENT, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF | DAICEL CHEMICAL INDUSTRIES, Ltd. (JP) | 2001-03-21 | — | — | EP | disclosed |