Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | TPMT | P51580 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9621103 | 1.00 | KDM4E (0.41) | KDM4EALDH1A1GLAMAOAHTT | |
| SCHEMBL9621005 | 0.97 | KDM4E (0.41) | KDM4EALDH1A1GLAMAOAHTT | |
| Hydrochloric Acid SCHEMBL10448152 | 0.95 | KDM4E (0.40) | KDM4EALDH1A1GLAMAOAHTT | |
| SCHEMBL1589841 | 0.90 | KDM4E (0.42) | KDM4EALDH1A1GLAMAOAHSD17B10 | |
| SCHEMBL9620921 | 0.86 | KDM4E (0.40) | KDM4EALDH1A1GLAMAOAHTT | |
| SCHEMBL9620925 | 0.86 | KDM4E (0.40) | KDM4EALDH1A1GLAMAOAHTT | |
| SCHEMBL9620994 | 0.83 | KDM4E (0.40) | KDM4EALDH1A1GLAMAOAHTT | |
| SCHEMBL9621006 | 0.83 | CHRNA7 (0.49) | KMT2ASMN1; SMN2HPGDRAB9AMEN1 | |
| SCHEMBL9621327 | 0.83 | CHRNA7 (0.49) | KMT2ASMN1; SMN2HPGDRAB9AMEN1 | |
| SCHEMBL1590323 | 0.82 | CYP3A4 (0.45) | KDM4EALDH1A1GLAMAOAHSD17B10 |
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 |