Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.73 |
| ▸ | TSHR | P16473 | 1/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.72 |
| ▸ | LMNA | P02545 | 2/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.72 |
| ▸ | PKM | P14618 | 1/20 | 0.72 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.58 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL51729 | 0.98 | ALDH1A1 (0.76) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| SCHEMBL27712513 | 0.98 | ALDH1A1 (0.76) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| Benzene SCHEMBL27648656 | 0.96 | ALDH1A1 (0.73) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| Ammonia Solution, Strong SCHEMBL27896729 | 0.96 | ALDH1A1 (0.73) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| Methane SCHEMBL27933203 | 0.96 | ALDH1A1 (0.73) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| SCHEMBL27864178 | 0.96 | ALDH1A1 (0.73) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| Bicarbonate SCHEMBL27679772 | 0.93 | ALDH1A1 (0.69) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| SCHEMBL366844 | 0.93 | ALDH1A1 (0.79) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| SCHEMBL9243743 | 0.91 | ALDH1A1 (0.68) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E | |
| SCHEMBL6984389 | 0.91 | ALDH1A1 (0.68) | ALDH1A1TSHRSMN1; SMN2LMNAKDM4E |
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-0799209-A1 | NOVEL SULFONAMIDES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-10-08 | — | — | EP | disclosed |
| WO-1996019459-A1 | NOVEL SULFONAMIDES | F. HOFFMANN-LA ROCHE AG (CH) | 1996-06-27 | — | — | WO | disclosed |