Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.61 |
| ▸ | CA2 | P00918 | 1/20 | 0.61 |
| ▸ | CA4 | P22748 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TLR4 | O00206 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 2/20 | 0.31 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.31 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CBR1 | P16152 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11862985 | 0.96 | CA1 (0.69) | CA1CA2CA4KMT2ATHRB | |
| SCHEMBL17634338 | 0.92 | KMT2A (0.73) | CA1CA2CA4KMT2ATHRB | |
| SCHEMBL27622 | 0.89 | CA1 (0.60) | CA1CA2CA4KMT2ATHRB | |
| SCHEMBL857124 | 0.89 | — | — | |
| SCHEMBL22708 | 0.89 | — | — | |
| SCHEMBL38785 | 0.89 | — | — | |
| Water SCHEMBL28084183 | 0.87 | — | — | |
| SCHEMBL4176635 | 0.84 | — | — | |
| SCHEMBL3486322 | 0.84 | — | — | |
| SCHEMBL106582 | 0.84 | — | — |
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-7468463-B2 | Method for producing optically active carbonyl compounds | BASF AG (DE) | 2008-12-23 | — | — | US | claimed |