Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9423640 | 1.00 | CA2 (0.46) | CA2TMEM97SIGMAR1ALDH1A1NPSR1 | |
| SCHEMBL9423852 | 1.00 | CA2 (0.46) | CA2TMEM97SIGMAR1ALDH1A1NPSR1 | |
| SCHEMBL221388 | 0.98 | — | — | |
| SCHEMBL23556 | 0.98 | — | — | |
| SCHEMBL220145 | 0.98 | — | — | |
| SCHEMBL4965571 | 0.98 | CA2 (0.47) | CA2TMEM97SIGMAR1ALDH1A1NPSR1 | |
| Ammonia Solution, Strong SCHEMBL21775798 | 0.95 | CA2 (0.46) | CA2TMEM97SIGMAR1ALDH1A1NPSR1 | |
| Alcohol SCHEMBL9421490 | 0.93 | CA2 (0.44) | CA2TMEM97SIGMAR1ALDH1A1NPSR1 | |
| Acetic Acid SCHEMBL15955948 | 0.90 | CA2 (0.46) | CA2TMEM97SIGMAR1ALDH1A1NPSR1 | |
| Dimethyl Sulfoxide SCHEMBL9985869 | 0.88 | CA2 (0.41) | CA2TMEM97SIGMAR1ALDH1A1NPSR1 |
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-5292740-A | Sulfonamides | HOFFMANN-LA ROCHE INC. (US) | 1994-03-08 | — | — | US | disclosed |