Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ALPL | P05186 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | PKLR | P30613 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8058006 | 1.00 | CTSL (0.35) | CTSLSOS1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL8056507 | 0.88 | CTSL (0.36) | CTSLALDH1A1HPGDHSD17B10PDK2 | |
| SCHEMBL8056511 | 0.88 | CTSL (0.36) | CTSLALDH1A1HPGDHSD17B10PDK2 | |
| SCHEMBL8056913 | 0.86 | ALDH1A1 (0.33) | ALDH1A1HPGDHSD17B10TSHRSLC6A3 | |
| SCHEMBL8056918 | 0.86 | ALDH1A1 (0.33) | ALDH1A1HPGDHSD17B10TSHRSLC6A3 | |
| SCHEMBL8056935 | 0.84 | — | — | |
| SCHEMBL8056931 | 0.84 | — | — | |
| SCHEMBL8058223 | 0.84 | CFTR (0.37) | SOS1PDK2MAPT | |
| SCHEMBL8058221 | 0.84 | CFTR (0.37) | SOS1PDK2MAPT | |
| SCHEMBL8060841 | 0.84 | CTSL (0.32) | CTSLALDH1A1HPGDHSD17B10TSHR |
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 |