Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 11/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | MPI | P34949 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Zinc Ion SCHEMBL9811236 | 0.90 | MAPT (0.42) | CASRMAPTGAAALDH1A1KDM4E | |
| SCHEMBL9811000 | 0.78 | CASR (0.46) | CASRMAPTGAAALDH1A1KMT2A | |
| SCHEMBL9811025 | 0.76 | CASR (0.41) | CASRMAPTGAAALDH1A1KDM4E | |
| Potassium Ion SCHEMBL9811283 | 0.76 | CASR (0.41) | CASRMAPTGAAALDH1A1KDM4E | |
| SCHEMBL9811089 | 0.73 | CASR (0.39) | CASRMAPTALDH1A1KMT2AHPGD | |
| SCHEMBL9811178 | 0.72 | NPC1 (0.38) | CASRMAPTGAAALDH1A1KDM4E | |
| SCHEMBL9811001 | 0.71 | CASR (0.44) | CASRMAPTGAAALDH1A1KDM4E | |
| Potassium Ion SCHEMBL9811290 | 0.69 | MAPT (0.40) | CASRMAPTGAAALDH1A1KDM4E | |
| SCHEMBL9811027 | 0.69 | MAPT (0.40) | CASRMAPTGAAALDH1A1KDM4E | |
| SCHEMBL24496148 | 0.69 | CASR (0.53) | CASRMAPTALDH1A1LOXL2HPGD |
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-0161219-B1 | HETEROCYCLIC MERCAPTOCARBOXYLIC-ACID ESTERS AND ANHYDRIDES AS CORROSION INHIBITING AGENTS | CIBA-GEIGY AG (CH) | 1991-06-12 | — | — | EP | disclosed |
| EP-0161219-A2 | Heterocyclic mercaptocarboxylic-acid esters and anhydrides as corrosion inhibiting agents | CIBA-GEIGY AG (CH) | 1985-11-13 | — | — | EP | disclosed |