Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 7/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 1/20 | 0.38 |
| ▸ | GABRD | O14764 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | GABRA4 | P48169 | 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 | |
|---|---|---|---|---|
| SCHEMBL202446 | 0.94 | ALDH1A1 (0.48) | ACACBKDM4EHPGDALDH1A1HTT | |
| SCHEMBL4929558 | 0.85 | ACACB (0.41) | ACACBALDH1A1CYP3A4GRM5HSD17B10 | |
| SCHEMBL4930416 | 0.84 | GABRG2 (0.49) | ACACBGABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL17276076 | 0.83 | ACACB (0.47) | ACACBGRM5CYP11B1CYP11B2 | |
| SCHEMBL7920952 | 0.81 | HCRTR1 (0.40) | ACACBALDH1A1CYP2D6GRM5CYP11B1 | |
| SCHEMBL13571061 | 0.78 | EPHX2 (0.44) | ACACBCYP2D6CYP3A4GRM5CYP11B1 | |
| SCHEMBL4937003 | 0.77 | MCHR1 (0.36) | ACACBGRM5CYP11B1CYP11B2 | |
| SCHEMBL447719 | 0.77 | LOX (0.47) | ACACBCYP3A4GAAGRM5 | |
| SCHEMBL29867993 | 0.77 | LOX (0.47) | ACACBCYP3A4GAAGRM5 | |
| SCHEMBL13571312 | 0.77 | NUDT1 (0.46) | ACACBGABRPGABRDGABRA1GABRB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5294612-A | Hypotensive agents and cardiovascular disorders | STERLING WINTHROP INC. (US) | 1994-03-15 | — | — | US | disclosed |