Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | CLK1 | P49759 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL346265 | 0.85 | CYP11B1 (0.51) | CYP11B1CYP11B2PTGS2KDM4EGLA | |
| SCHEMBL9621184 | 0.78 | S1PR1 (0.43) | CYP11B1CYP11B2KDM4EHSD17B10S1PR1 | |
| SCHEMBL9621234 | 0.77 | TP53 (0.44) | KDM4EALDH1A1KMT2AMEN1S1PR1 | |
| SCHEMBL8484091 | 0.74 | NOTUM (0.38) | PTGS2KDM4EALDH1A1CA12CA9 | |
| SCHEMBL8483356 | 0.74 | CYP11B2 (0.46) | CYP11B2PTGS2KDM4EGLAKMT2A | |
| SCHEMBL9221697 | 0.74 | CYP11B1 (0.51) | CYP11B1CYP11B2PTGS2KDM4EGLA | |
| SCHEMBL5694242 | 0.73 | S1PR1 (0.46) | KDM4EHSD17B10MAOBS1PR1S1PR3 | |
| SCHEMBL8064409 | 0.73 | MAOB (0.51) | KDM4EALDH1A1KMT2AMEN1HSD17B10 | |
| SCHEMBL5694167 | 0.72 | CA12 (0.54) | CYP11B1CYP11B2PTGS2KDM4EGLA | |
| SCHEMBL9621213 | 0.72 | CYP11B1 (0.50) | CYP11B1CYP11B2PTGS2KDM4EGLA |
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-0284359-B1 | 1,4-DISUBSTITUTED PIPERAZINE COMPOUNDS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1992-01-08 | — | — | EP | disclosed |
| US-4880809-A | HYPOTENSIVE AGENTS, AMIDE DERIVATIVES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1989-11-14 | — | — | US | disclosed |
| EP-0284359-A1 | 1,4-Disubstituted piperazine compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1988-09-28 | — | — | EP | disclosed |