Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PTPRC | P08575 | 2/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | PTPRF | P10586 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8056464 | 0.85 | HPGD (0.42) | EGFRPTGS2TSHRALDH1A1HPGD | |
| SCHEMBL8056463 | 0.78 | CA1 (0.50) | EGFRPTPRCALDH1A1HPGDKDM4E | |
| SCHEMBL10458005 | 0.76 | PTGS2 (0.76) | EGFRPTGS2TSHRPTPRCPTPN1 | |
| SCHEMBL14832783 | 0.74 | EGFR (0.79) | EGFRPTGS2TSHRALDH1A1HPGD | |
| SCHEMBL17615090 | 0.74 | EGFR (0.60) | EGFRPTGS2TSHRPTPRCPTPN1 | |
| SCHEMBL10058712 | 0.73 | EGFR (0.63) | EGFRPTGS2TSHRALDH1A1HPGD | |
| SCHEMBL3748237 | 0.73 | EGFR (0.63) | EGFRPTGS2TSHRALDH1A1HPGD | |
| SCHEMBL15398420 | 0.72 | CA1 (0.53) | EGFRTSHRPTPRCALDH1A1HPGD | |
| SCHEMBL3910111 | 0.72 | EGFR (0.61) | EGFRPTGS2TSHRALDH1A1KDM4E | |
| SCHEMBL31222697 | 0.72 | EGFR (0.61) | EGFRPTGS2TSHRALDH1A1RAB9A |
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-6028069-A | Heterocyclyl-condensed benzoylguanidines, their production and use as inhibitors of the cellular Na+/H+-antiporter | MERCK PATENT GESELLSCHAFT MIT BERSCHRANKER HAFTUNG (DE) | 2000-02-22 | — | — | US | disclosed |