Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20265143 | 0.94 | SIGMAR1 (0.44) | KEAP1SMN1; SMN2ALOX15SIGMAR1CYP2D6 | |
| SCHEMBL1616800 | 0.81 | — | — | |
| SCHEMBL101501 | 0.81 | KEAP1 (0.67) | KEAP1SMN1; SMN2ALOX15SIGMAR1CYP2D6 | |
| SCHEMBL4630069 | 0.78 | GNAI3 (0.44) | SIGMAR1 | |
| SCHEMBL1306553 | 0.78 | MEN1 (0.35) | SMN1; SMN2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL3673979 | 0.78 | KEAP1 (0.64) | KEAP1SMN1; SMN2ALOX15SIGMAR1CYP2D6 | |
| SCHEMBL15329386 | 0.78 | KEAP1 (0.64) | KEAP1SMN1; SMN2ALOX15SIGMAR1CYP2D6 | |
| SCHEMBL4901787 | 0.77 | GNAI3 (0.52) | SIGMAR1 | |
| SCHEMBL4559690 | 0.76 | ALOX15 (0.77) | KEAP1SMN1; SMN2ALOX15SIGMAR1CYP2D6 | |
| SCHEMBL18071938 | 0.76 | KEAP1 (0.61) | KEAP1SMN1; SMN2ALOX15SIGMAR1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0620216-B1 | Benzamide derivatives and their use as vasopressin antagonists | FUJISAWA PHARMACEUTICAL CO (JP) | 2003-01-08 | — | — | EP | disclosed |
| US-5521170-A | VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-05-28 | — | — | US | disclosed |
| EP-0620216-A1 | Benzamide derivatives and their use as vasopressin antagonists | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-10-19 | — | — | EP | disclosed |