Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11248802 | 0.89 | CA2 (0.46) | CA2CA1KDM4EUSP2ALDH1A1 | |
| SCHEMBL7214 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL8954274 | 0.86 | — | — | |
| SCHEMBL20637763 | 0.86 | — | — | |
| Sulfuric Acid SCHEMBL15821656 | 0.86 | CA2 (0.48) | CA2CA1ALDH1A1LMNATSHR | |
| SCHEMBL7587942 | 0.86 | — | — | |
| SCHEMBL7927312 | 0.86 | — | — | |
| Ethane SCHEMBL9438385 | 0.86 | — | — | |
| SCHEMBL17456541 | 0.86 | — | — | |
| SCHEMBL3277002 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999042473-A9 | INHIBITION OF TOXIN TRANSLOCATION | HARVARD COLLEGE (US) | 1999-11-04 | — | — | WO | disclosed |
| WO-1999042473-A1 | INHIBITION OF TOXIN TRANSLOCATION | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1999-08-26 | — | — | WO | disclosed |