Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7694457 | 0.89 | CA1 (0.39) | ALDH1A1SLC18A2TSHRCYP1A2CYP2C19 | |
| SCHEMBL7386441 | 0.88 | SLC18A2 (0.36) | SLC18A2TSHRCYP1A2CYP2C19MAPT | |
| SCHEMBL7377280 | 0.88 | KDM4E (0.42) | ADRA2AADRA2BADRA1AL3MBTL1ALDH1A1 | |
| SCHEMBL7700908 | 0.87 | SLC18A2 (0.36) | ALDH1A1SLC18A2TSHRCYP1A2CYP2C19 | |
| SCHEMBL7388475 | 0.86 | NLRP3 (0.36) | ALDH1A1SLC18A2TSHRCYP1A2CYP2C19 | |
| SCHEMBL7417781 | 0.85 | TSHR (0.41) | ALDH1A1SLC18A2TSHRCYP1A2CYP2C19 | |
| SCHEMBL7381343 | 0.83 | TRPV1 (0.40) | ALDH1A1SLC18A2TSHRMAPTGAA | |
| SCHEMBL7388883 | 0.76 | MAP3K14 (0.52) | ALDH1A1TSHRMAPTMAP3K14KDM4E | |
| SCHEMBL7527688 | 0.75 | KDM4C (0.41) | ADRA2AALDH1A1TSHRMAPTSMN1; SMN2 | |
| SCHEMBL7701240 | 0.73 | SLC6A4 (0.33) | TSHRCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998055475-A1 | GUANIDINE DERIVIATIVES AS INHIBITORS OF NA+/H+ EXCHANGE IN CELLS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1998-12-10 | — | — | WO | disclosed |