Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 2/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 2/20 | 0.31 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.31 |
| ▸ | CSNK2B | P67870 | 2/20 | 0.31 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.31 |
| ▸ | TNKS | O95271 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9166348 | 0.81 | IDH1 (0.37) | PARP1PIK3CDPIK3CBPIK3CGIDH1 | |
| SCHEMBL9846292 | 0.75 | SCN9A (0.35) | PARP1PIK3CDPIK3CBPIK3CGIDH1 | |
| SCHEMBL9846224 | 0.73 | PARP1 (0.37) | PARP1PIK3CDPIK3CBPIK3CGPTGES | |
| SCHEMBL9166681 | 0.69 | PIK3CD (0.41) | PARP1PIK3CDPIK3CBPIK3CGIDH1 | |
| L-697661 SCHEMBL599639 | 0.66 | FABP4 (0.34) | IDH1FABP4ALDH1A1GLAMAPT | |
| L-697661 SCHEMBL29456987 | 0.66 | FABP4 (0.34) | IDH1FABP4ALDH1A1GLAMAPT | |
| SCHEMBL9168366 | 0.65 | MTNR1A (0.37) | PARP1 | |
| SCHEMBL9846171 | 0.65 | MAPT (0.40) | PIK3CDPIK3CBALDH1A1GAAMAPT | |
| SCHEMBL9846141 | 0.64 | MAPT (0.38) | ALDH1A1GAAMAPTNR4A2F2 | |
| SCHEMBL15066674 | 0.63 | SMN1; SMN2 (0.46) | ALDH1A1MAPTCYP2C19HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0462800-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |