Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | GPR174 | Q9BXC1 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL6714454 | 0.97 | ALDH1A1 (0.39) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 | |
| SCHEMBL570809 | 0.97 | ALDH1A1 (0.39) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 | |
| SCHEMBL28076 | 0.84 | GPR174 (0.40) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 | |
| SCHEMBL29377861 | 0.84 | GPR174 (0.40) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 | |
| SCHEMBL6716847 | 0.84 | ALDH1A1 (0.40) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 | |
| SCHEMBL570810 | 0.83 | GPR174 (0.39) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 | |
| SCHEMBL570808 | 0.83 | GPR174 (0.39) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 | |
| Ammonia Solution, Strong SCHEMBL6716826 | 0.83 | GPR174 (0.39) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 | |
| SCHEMBL6710041 | 0.78 | ALDH1A1 (0.40) | ALDH1A1POLBSMN1; SMN2HSD17B10KMT2A | |
| SCHEMBL9750660 | 0.77 | SMN1; SMN2 (0.48) | ALDH1A1HTTPOLBSMN1; SMN2GPR174 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6740722-B2 | Low density acrylic fiber | SOLUTIA INC. | 2004-05-25 | — | — | US | disclosed |
| US-20030057593-A1 | Low density acrylic fiber | ASCEND PERFORMANCE MATERIALS OPERATIONS LLC | 2003-03-27 | — | — | US | disclosed |
| WO-1999058586-A1 | ACRYLIC FIBER POLYMER PRECURSOR AND FIBER | SOLUTIA INC. (US) | 1999-11-18 | — | — | WO | disclosed |