Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | GUSB | P08236 | 1/20 | 0.54 |
| ▸ | CACNA1C | Q13936 | 4/20 | 0.49 |
| ▸ | CACNA1F | O60840 | 3/20 | 0.49 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.49 |
| ▸ | CACNA1S | Q13698 | 3/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9805495 | 1.00 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1LMNAGUSBCACNA1C | |
| SCHEMBL9805492 | 0.86 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1LMNAGUSBCACNA1C | |
| SCHEMBL9805484 | 0.86 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1LMNAGUSBCACNA1C | |
| SCHEMBL8108247 | 0.85 | ALDH1A1 (0.63) | ALDH1A1L3MBTL1LMNAGUSBCACNA1C | |
| SCHEMBL19732964 | 0.85 | ALDH1A1 (0.63) | ALDH1A1L3MBTL1LMNAGUSBCACNA1C | |
| SCHEMBL7265815 | 0.84 | ALDH1A1 (0.83) | ALDH1A1L3MBTL1LMNAGUSBCACNA1C | |
| SCHEMBL9814256 | 0.83 | ALDH1A1 (0.62) | ALDH1A1L3MBTL1LMNAGUSBCACNA1C | |
| SCHEMBL3940339 | 0.78 | CACNA1F (0.71) | LMNACACNA1CCACNA1FCACNA1DCACNA1S | |
| SCHEMBL3032197 | 0.78 | CACNA1F (0.71) | LMNACACNA1CCACNA1FCACNA1DCACNA1S | |
| Hydrochloric Acid SCHEMBL9374064 | 0.77 | CACNA1F (0.70) | LMNACACNA1CCACNA1FCACNA1DCACNA1S |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0234830-B1 | 2-(SUBSTITUTED IMINO)-6-ARYL-3,6-DIHYDRO-4-SUBSTITUTED-1,5(2H)-PYRIMIDINECARBOXYLIC ACIDS AND ANALOGS | E.R. Squibb & Sons, Inc. (US) | 1991-04-24 | — | — | EP | disclosed |
| EP-0234830-A1 | 2-(Substituted imino)-6-aryl-3,6-dihydro-4-substituted-1,5(2H)-pyrimidinecarboxylic acids and analogs | E.R. Squibb & Sons, Inc. (US) | 1987-09-02 | — | — | EP | disclosed |
| US-4689414-A | 2-(substituted imino)-6-aryl-3,6-dihydro-4-substituted-1,5(2H)-pyrimidinecarboxylic acids and analogs | E. R. SQUIBB & SONS, INC. (US) | 1987-08-25 | — | — | US | disclosed |