Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8017404 | 0.92 | ALDH1A1 (0.36) | ALDH1A1MAPK1L3MBTL1SYKMAPT | |
| SCHEMBL8019716 | 0.81 | AKT1 (0.39) | — | |
| SCHEMBL1455947 | 0.80 | ALDH1A1 (0.40) | ALDH1A1MAPK1L3MBTL1SYKMAPT | |
| SCHEMBL8007712 | 0.80 | KLK7 (0.37) | ALDH1A1MAPK1L3MBTL1SYKMAPT | |
| SCHEMBL24067603 | 0.80 | MEN1 (0.39) | ALDH1A1SYKMAPTXBP1NPSR1 | |
| SCHEMBL5557245 | 0.79 | CA1 (0.51) | ALDH1A1MAPK1L3MBTL1SYKTDP1 | |
| SCHEMBL7737502 | 0.79 | CA1 (0.51) | ALDH1A1MAPK1L3MBTL1SYKTDP1 | |
| SCHEMBL418232 | 0.77 | ALDH1A1 (0.51) | ALDH1A1MAPK1L3MBTL1SYKMAPT | |
| SCHEMBL24067604 | 0.76 | MEN1 (0.37) | ALDH1A1SYKMAPTXBP1NPSR1 | |
| SCHEMBL18429584 | 0.76 | SYK (0.50) | ALDH1A1MAPK1L3MBTL1SYKMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000058266-A1 | DIVERGENT METHOD FOR THE SYNTHESIS OF DIETHYLENE TRIAMINEPENTA ACETICACID ESTERS | MALLINCKRODT INC. (US) | 2000-10-05 | — | — | WO | disclosed |