Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 4/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HBB | P68871 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL9130467 | 0.85 | ALDH1A1 (0.40) | ALDH1A1TSHRALOX15HSD17B10MEN1 | |
| SCHEMBL6971747 | 0.83 | ALDH1A1 (0.46) | ALDH1A1TSHRALOX15HSD17B10MEN1 | |
| SCHEMBL1578958 | 0.83 | TSHR (0.54) | ALDH1A1TSHRALOX15HSD17B10MEN1 | |
| SCHEMBL8013623 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10MEN1KMT2A | |
| SCHEMBL9131675 | 0.80 | CHRM5 (0.47) | ALDH1A1TSHRALOX15HSD17B10MEN1 | |
| SCHEMBL13917807 | 0.78 | ALDH1A1 (0.58) | ALDH1A1TSHRALOX15HSD17B10MEN1 | |
| SCHEMBL142069 | 0.78 | ALDH1A1 (0.58) | ALDH1A1TSHRALOX15HSD17B10MEN1 | |
| SCHEMBL9241732 | 0.78 | ADK (0.48) | ALDH1A1TSHRHSD17B10MEN1KMT2A | |
| SCHEMBL4886100 | 0.76 | ALDH1A1 (0.55) | ALDH1A1TSHRALOX15HSD17B10MEN1 | |
| SCHEMBL17160801 | 0.76 | ALDH1A1 (0.55) | ALDH1A1TSHRALOX15HSD17B10MEN1 |
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-1993022259-A1 | A PROCESS FOR PRODUCING 1,4-BISARYL-BUTANE-1,4-DIONES AND POLY(ARYLENE-BUTANE-1,4-DIONES) | NKT RESEARCH CENTER A/S (DK) | 1993-11-11 | — | — | WO | disclosed |