Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 3/20 | 0.53 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.53 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.52 |
| ▸ | SLC9A2 | Q9UBY0 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4450205 | 0.95 | SLC9A1 (0.48) | KEAP1NFE2L2SLC9A1SLC9A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6314755 | 0.94 | SLC9A1 (0.48) | KEAP1NFE2L2SLC9A1SLC9A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6321489 | 0.93 | SLC9A1 (0.47) | KEAP1NFE2L2SLC9A1SLC9A2ALDH1A1 | |
| SCHEMBL4452217 | 0.88 | KEAP1 (0.67) | KEAP1NFE2L2SLC9A1SLC9A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6312407 | 0.87 | KEAP1 (0.66) | KEAP1NFE2L2SLC9A1SLC9A2ALDH1A1 | |
| SCHEMBL4452076 | 0.82 | TP53 (0.47) | SLC9A1SLC9A2POLBMAPTLMNA | |
| SCHEMBL4452480 | 0.82 | SMN1; SMN2 (0.40) | KEAP1NFE2L2SLC9A1SLC9A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6311494 | 0.82 | TP53 (0.46) | SLC9A1SLC9A2POLBMAPTLMNA | |
| SCHEMBL4446803 | 0.81 | SLC9A1 (0.51) | KEAP1NFE2L2SLC9A1SLC9A2MAPT | |
| SCHEMBL6482935 | 0.81 | TP53 (0.43) | SLC9A1SLC9A2POLBKMT2AMAPT |
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-6423705-B1 | FOR ISCHEMIA BY ADMINISTERING AN NHE-1 INHIBITOR AND A SECOND COMPOUND SELECTED FROM COMPLEMENT MODULATOR, METABOLIC MODULATOR, ANTIAPOPTOTIC AGENT, NITRIC OXIDE SYNTHASE-RELATED AGENT, AND AN ENZYME/PROTEIN MODULATOR | PFIZER INC. | 2002-07-23 | — | — | US | claimed |