Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.60 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.60 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.60 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.60 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.60 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.60 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL10366636 | 0.94 | CYP2C9 (0.59) | CYP2C9ABCB11SLC6A3KDM4EMEN1 | |
| SCHEMBL10367481 | 0.94 | ADRA1A (0.61) | CYP2C9ABCB11SLC6A3KDM4EMEN1 | |
| SCHEMBL10365985 | 0.94 | SLC6A3 (0.50) | CYP2C9ABCB11SLC6A3KDM4EMEN1 | |
| SCHEMBL7279434 | 0.90 | ABCB11 (0.54) | CYP2C9ABCB11SLC6A3KDM4EMEN1 | |
| SCHEMBL10847722 | 0.89 | CYP2C9 (0.59) | CYP2C9ABCB11SLC6A3KDM4EMEN1 | |
| SCHEMBL10365442 | 0.88 | ADRA1A (0.60) | CYP2C9ABCB11SLC6A3KDM4EMEN1 | |
| SCHEMBL10365083 | 0.88 | SLC6A3 (0.52) | CYP2C9ABCB11SLC6A3KDM4EMEN1 | |
| SCHEMBL10366249 | 0.87 | SLC6A3 (0.58) | CYP2C9ABCB11SLC6A3KDM4EMEN1 | |
| SCHEMBL10366943 | 0.85 | ABCC1 (0.60) | ABCB11SLC6A3ADORA3ADRA1AOPRK1 | |
| SCHEMBL10365326 | 0.84 | CACNA1B (0.62) | ADORA3CACNA1CCACNA1FCACNA1DCACNA1S |
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-0094159-B1 | DIHYDROPYRIDINE DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1990-03-14 | — | — | EP | disclosed |
| US-4892875-A | HYPOTENSIVE, RENAL VASODILATION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-01-09 | — | — | US | disclosed |
| EP-0094159-A1 | Dihydropyridine derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1983-11-16 | — | — | EP | disclosed |