Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL15962413 | 0.76 | CA1 (0.33) | CA1CA2CA4KMT2A | |
| SCHEMBL2511084 | 0.74 | — | — | |
| SCHEMBL15418263 | 0.73 | CA1 (0.35) | CA1CA2CA4KMT2A | |
| SCHEMBL1778887 | 0.72 | HCAR2 (0.35) | CA1CA2CA4KMT2A | |
| SCHEMBL511158 | 0.70 | — | — | |
| SCHEMBL3987055 | 0.70 | TLR4 (0.33) | — | |
| SCHEMBL159498 | 0.67 | — | — | |
| SCHEMBL13715432 | 0.67 | — | — | |
| SCHEMBL9854226 | 0.67 | CA1 (0.37) | CA1CA2CA4KMT2ACA9 | |
| SCHEMBL16657572 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6605639-B1 | Treating and/or preventing diseases alleviated by retinoid X receptor ligand dependent transcriptional regulation using ascochlorin or derivatives | NUCLEAR RECEPTOR RESEARCH, LTD. (JP) | 2003-08-12 | — | — | US | disclosed |
| EP-1142870-A1 | NOVEL LIGANDS OF NUCLEAR RECEPTOR | Nuclear Receptor Research Limited (JP) | 2001-10-10 | — | — | EP | disclosed |