Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4418524 | 1.00 | CA1 (0.41) | CA1CA2CA4KMT2A | |
| SCHEMBL2689132 | 0.81 | CA1 (0.35) | CA1CA2CA4KMT2A | |
| SCHEMBL2688325 | 0.78 | CA1 (0.37) | CA1CA2CA4KMT2A | |
| SCHEMBL7654247 | 0.77 | UGT2B17 (0.35) | — | |
| SCHEMBL9852673 | 0.77 | — | — | |
| SCHEMBL7662301 | 0.72 | — | — | |
| SCHEMBL11744054 | 0.71 | CA1 (0.31) | CA1CA2CA4KMT2A | |
| SCHEMBL11744056 | 0.71 | CA1 (0.31) | CA1CA2CA4KMT2A | |
| SCHEMBL14690135 | 0.70 | CA1 (0.37) | CA1CA2CA4KMT2A | |
| SCHEMBL11746666 | 0.69 | CA1 (0.38) | CA1CA2CA4KMT2A |
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-2152673-A2 | 3- TO 7-MEMBERED 1,3-DIAZA-4-OXO-HETEROCYCLIC DERIVATIVES CAPABLE OF RELEASING ACTIVE ALDEHYDES OR KETONES | Firmenich S.A. (CH) | 2010-02-17 | — | — | EP | disclosed |
| WO-2008142591-A2 | 3- TO 7-MEMBERED 1,3-DIAZA-4-OXO-HETEROCYCLIC DERIVATIVES CAPABLE OF RELEASING ACTIVE ALDEHYDES OR KETONES | FIRMENICH SA (CH) | 2008-11-27 | — | — | WO | disclosed |