Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.83 |
| ▸ | HPGD | P15428 | 6/20 | 0.78 |
| ▸ | POLB | P06746 | 4/20 | 0.78 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.78 |
| ▸ | CASP1 | P29466 | 2/20 | 0.78 |
| ▸ | CASP7 | P55210 | 2/20 | 0.78 |
| ▸ | LMNA | P02545 | 1/20 | 0.78 |
| ▸ | BAP1 | Q92560 | 1/20 | 0.78 |
| ▸ | THRB | P10828 | 2/20 | 0.64 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 4/20 | 0.64 |
| ▸ | TP53 | P04637 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1718482 | 0.93 | ALDH1A1 (0.80) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1718435 | 0.91 | ALDH1A1 (1.00) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1719197 | 0.91 | ALDH1A1 (0.78) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1718614 | 0.89 | HPGD (0.74) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1717790 | 0.87 | ALDH1A1 (1.00) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1719150 | 0.85 | HPGD (0.63) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1719343 | 0.85 | ALDH1A1 (0.68) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1718976 | 0.84 | THRB (0.77) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1717957 | 0.84 | TTR (0.70) | ALDH1A1HPGDPOLBHSD17B10CASP1 | |
| SCHEMBL1718061 | 0.84 | TP53 (0.67) | ALDH1A1HPGDPOLBHSD17B10CASP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1506196-B1 | PYRAZOLOPYRIMIDINES AS SODIUM CHANNEL INHIBITORS | ICAGEN INC (US) | 2012-01-18 | — | — | EP | claimed |
| EP-1506196-B1 | PYRAZOLOPYRIMIDINES AS SODIUM CHANNEL INHIBITORS | ICAGEN INC (US) | 2012-01-18 | — | — | EP | disclosed |