Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | REN | P00797 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.44 |
| ▸ | CPA3 | P15088 | 3/20 | 0.43 |
| ▸ | CPA1 | P15085 | 3/20 | 0.43 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.43 |
| ▸ | CPB1 | P15086 | 1/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7382334 | 1.00 | CYP1A2 (0.47) | CYP1A2HSD17B10RENCHRM1CPA3 | |
| SCHEMBL7439450 | 0.90 | REN (0.43) | CYP1A2HSD17B10RENCHRM1PKM | |
| SCHEMBL7384720 | 0.88 | GAA (0.45) | HSD17B10RENCHRM1 | |
| SCHEMBL9820259 | 0.87 | CPA3 (0.50) | CYP1A2HSD17B10RENCPA3CPA1 | |
| Hydrochloric Acid SCHEMBL7290196 | 0.86 | CPA3 (0.49) | CYP1A2HSD17B10RENCPA3CPA1 | |
| SCHEMBL7273127 | 0.85 | CYP1A2 (0.54) | CYP1A2RENCPA3CPA1FOLH1 | |
| SCHEMBL7273137 | 0.85 | CYP1A2 (0.54) | CYP1A2RENCPA3CPA1FOLH1 | |
| SCHEMBL9445001 | 0.84 | CYP1A2 (0.53) | CYP1A2RENCPA3CPA1FOLH1 | |
| SCHEMBL9445007 | 0.84 | CYP1A2 (0.53) | CYP1A2RENCPA3CPA1FOLH1 | |
| SCHEMBL7414519 | 0.84 | CYP1A2 (0.53) | CYP1A2RENCPA3CPA1FOLH1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0341602-A2 | Renin-inhibiting functionalized peptidyl aminodiols and - triols | ABBOTT LABORATORIES (US) | 1989-11-15 | — | — | EP | disclosed |