Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CCR4 | P51679 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | REN | P00797 | 1/20 | 0.42 |
| ▸ | ACE | P12821 | 1/20 | 0.42 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.42 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5113576 | 0.99 | CYP2C19 (0.46) | CYP2C19SMN1; SMN2TSHRCCR4KMT2A | |
| SCHEMBL7038379 | 0.98 | CYP2C19 (0.47) | CYP2C19SMN1; SMN2TSHRCCR4KMT2A | |
| Hydrochloric Acid SCHEMBL5114286 | 0.98 | CYP2C19 (0.46) | CYP2C19SMN1; SMN2TSHRCCR4KMT2A | |
| SCHEMBL5123989 | 0.90 | CYP2C19 (0.44) | CYP2C19SMN1; SMN2TSHRKMT2AMEN1 | |
| SCHEMBL5110952 | 0.90 | CYP2C19 (0.44) | CYP2C19SMN1; SMN2TSHRKMT2AMEN1 | |
| SCHEMBL5123449 | 0.90 | CYP2C19 (0.44) | CYP2C19SMN1; SMN2TSHRKMT2AMEN1 | |
| SCHEMBL5123437 | 0.90 | CYP2C19 (0.44) | CYP2C19SMN1; SMN2TSHRKMT2AMEN1 | |
| SCHEMBL5124757 | 0.90 | CYP2C19 (0.44) | CYP2C19SMN1; SMN2TSHRKMT2AMEN1 | |
| SCHEMBL4564775 | 0.90 | CYP2C19 (0.44) | CYP2C19SMN1; SMN2TSHRKMT2AMEN1 | |
| SCHEMBL5123888 | 0.90 | CYP2C19 (0.46) | CYP2C19SMN1; SMN2TSHRCCR4KMT2A |
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-6605608-B1 | Such as n-(1-benzylpiperidin-4-yl)-3-cyclohexylmethylthio-2-((4R)-3-t -butoxycarbonylthiazolidin-4-ylcarbonylamino)propan-a mide; n-type calcium channel inhibitors | ONO PHARMACEUTICAL CO., LTD (JP) | 2003-08-12 | — | — | US | claimed |
| EP-1090912-A1 | AMINO ACID DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | ONO PHARMACEUTICAL CO., LTD. (JP) | 2001-04-11 | — | — | EP | claimed |