Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7293036 | 0.84 | MEN1 (0.51) | GAANPSR1MAPTALDH1A1POLB | |
| SCHEMBL7278235 | 0.77 | CYP1A2 (0.52) | ALDH1A1LMNAKMT2ACYP2C19 | |
| SCHEMBL7337786 | 0.77 | GAA (0.39) | GAAPKMNPC1RAB9AACE2 | |
| SCHEMBL7034646 | 0.76 | GAA (0.46) | GAANPSR1PKMMAPTALDH1A1 | |
| SCHEMBL7332863 | 0.75 | HSD17B10 (0.46) | GAANPSR1PKMMAPTALDH1A1 | |
| SCHEMBL7334542 | 0.74 | CYP2D6 (0.56) | ALDH1A1NPC1POLBLMNATSHR | |
| Hydrochloric Acid SCHEMBL7338311 | 0.74 | KMT2A (0.55) | GAANPSR1PKMMAPTALDH1A1 | |
| SCHEMBL9325914 | 0.73 | ALDH1A1 (0.49) | ALDH1A1KMT2ACYP2C19 | |
| SCHEMBL7309732 | 0.73 | ALDH1A1 (0.49) | ALDH1A1KMT2ACYP2C19 | |
| SCHEMBL7300596 | 0.73 | ALDH1A1 (0.49) | ALDH1A1KMT2ACYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1989010751-A1 | FUNCTIONALIZED PEPTIDYL AMINODIOLS AND -TRIOLS | ABBOTT LABORATORIES (US) | 1989-11-16 | — | — | WO | disclosed |
| EP-0341602-A2 | Renin-inhibiting functionalized peptidyl aminodiols and - triols | ABBOTT LABORATORIES (US) | 1989-11-15 | — | — | EP | disclosed |