Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 13/20 | 0.34 |
| ▸ | FPR2 | P25090 | 9/20 | 0.34 |
| ▸ | SYK | P43405 | 3/20 | 0.33 |
| ▸ | SCN1A | P35498 | 2/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.33 |
| ▸ | SCN8A | Q9UQD0 | 2/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | SCN1B | Q07699 | 1/20 | 0.33 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL6616473 | 0.85 | SCN9A (0.35) | KDM4ESCN9AFPR2SCN1ASCN5A | |
| SCHEMBL6211278 | 0.85 | SCN9A (0.35) | KDM4ESCN9AFPR2SCN1ASCN5A | |
| SCHEMBL175753 | 0.84 | ALDH1A1 (0.42) | KDM4ESCN9ASCN1ASCN5ASCN8A | |
| SCHEMBL3516836 | 0.84 | ALDH1A1 (0.42) | KDM4ESCN9ASCN1ASCN5ASCN8A | |
| SCHEMBL175752 | 0.84 | ALDH1A1 (0.42) | KDM4ESCN9ASCN1ASCN5ASCN8A | |
| Hydrochloric Acid SCHEMBL6498236 | 0.83 | SCN9A (0.34) | KDM4ESCN9AFPR2SCN1ASCN5A | |
| Hydrochloric Acid SCHEMBL7300448 | 0.83 | ALDH1A1 (0.41) | KDM4ESCN9ASCN1ASCN5ASCN8A | |
| SCHEMBL9217841 | 0.72 | FPR2 (0.32) | SCN9AFPR2 | |
| SCHEMBL11348714 | 0.71 | CCNE1 (0.44) | KDM4EALDH1A1TSHR | |
| SCHEMBL2522189 | 0.69 | KDM4E (0.38) | KDM4ESYKALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0307837-A2 | Renin-inhibiting peptidyl heterocycles | ABBOTT LABORATORIES (US) | 1989-03-22 | — | — | EP | claimed |
| US-6281235-B1 | CONTROL OF HYPERTENSION. | G.D. SEARLE & CO. | 2001-08-28 | — | — | US | disclosed |
| US-5849773-A | Amino acyl amino propargyl diol compounds for treatment of hypertension | G. D. SEARLE & CO. (US) | 1998-12-15 | — | — | US | disclosed |
| US-5330996-A | Renin inhibitors | G. D. SEARLE & CO. (US) | 1994-07-19 | — | — | US | disclosed |
| EP-0307837-A2 | Renin-inhibiting peptidyl heterocycles | ABBOTT LABORATORIES (US) | 1989-03-22 | — | — | EP | disclosed |