Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9733717 | 0.89 | GAA (0.50) | ALDH1A1KDM4EGAATSHRTNKS | |
| SCHEMBL9736223 | 0.84 | ALDH1A1 (0.61) | ALDH1A1KDM4ETDP1GAAMAPT | |
| SCHEMBL9733660 | 0.78 | ALDH1A1 (0.79) | ALDH1A1KDM4ETDP1GAAMAPT | |
| SCHEMBL9734162 | 0.75 | GAA (0.79) | ALDH1A1KDM4ETDP1GAAMAPT | |
| SCHEMBL9849218 | 0.75 | ALDH1A1 (0.62) | ALDH1A1KDM4ETDP1GAAMAPT | |
| SCHEMBL9734499 | 0.72 | GAA (0.69) | ALDH1A1KDM4ETDP1GAAMAPT | |
| SCHEMBL13899835 | 0.72 | TNKS (0.63) | ALDH1A1KDM4EGAAMAPTTNKS | |
| SCHEMBL31255953 | 0.72 | TNKS (0.63) | ALDH1A1KDM4EGAAMAPTTNKS | |
| SCHEMBL9733677 | 0.72 | CA1 (0.53) | ALDH1A1KDM4ETDP1GAAMAPT | |
| SCHEMBL9734467 | 0.72 | ALDH1A1 (0.68) | ALDH1A1KDM4ETDP1GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5106975-A | Hexahydropyrimidine derivatives | ETHYL PETROLEUM ADDITIVES, INC. (US) | 1992-04-21 | — | — | US | disclosed |
| EP-0434185-A2 | Hexahydropyrimidine derivatives | ETHYL PETROLEUM ADDITIVES, INC. (US) | 1991-06-26 | — | — | EP | disclosed |