Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 5/20 | 0.65 |
| ▸ | LMNA | P02545 | 4/20 | 0.65 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.65 |
| ▸ | PGR | P06401 | 2/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.65 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.65 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.65 |
| ▸ | ESR1 | P03372 | 1/20 | 0.65 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.65 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.65 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.65 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.65 |
| ▸ | HTR2B | P41595 | 1/20 | 0.65 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.65 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL259434 | 1.00 | AR (0.65) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL8846925 | 1.00 | AR (0.65) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL5296168 | 1.00 | AR (0.65) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL259433 | 1.00 | AR (0.65) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL18812341 | 0.94 | LMNA (0.66) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL11644576 | 0.89 | LMNA (0.65) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL11644583 | 0.89 | LMNA (0.65) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL7787111 | 0.89 | AR (0.62) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL9404138 | 0.89 | AR (0.62) | ARLMNANR3C1PGRCYP3A4 | |
| SCHEMBL11646428 | 0.86 | AR (0.61) | ARLMNANR3C1PGRCYP3A4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4323500-A | REACTING WITH A THIOCARBOXYLIC ACID | MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) | 1982-04-06 | — | — | US | claimed |
| EP-0808171-A2 | COMBINATION OF ANGIOTENSIN CONVERTING ENZYME INHIBITOR, SIDE-EFFECT-REDUCED AMOUNT OF ALDOSTERONE ANTAGONIST AND DIURETIC | G.D. SEARLE & CO. (US) | 1997-11-26 | — | — | EP | disclosed |
| WO-1996024372-A2 | COMBINATION OF ANGIOTENSIN CONVERTING ENZYME INHIBITOR, SIDE-EFFECT-REDUCED AMOUNT OF ALDOSTERONE ANTAGONIST AND DIURETIC | G.D. SEARLE & CO. (US) | 1996-08-15 | — | — | WO | disclosed |
| US-4323500-A | REACTING WITH A THIOCARBOXYLIC ACID | MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) | 1982-04-06 | — | — | US | disclosed |
| US-4213902-A | Process for producing steroidal 7α-acylthio-4-en-3-ones | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) | 1980-07-22 | — | — | US | disclosed |