Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | WNT3A | P56704 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27528543 | 0.91 | CA12 (0.48) | CA12CA1CA2CA9CYP19A1 | |
| SCHEMBL2670006 | 0.80 | CA12 (0.46) | CA12CA1CA2CA9CYP19A1 | |
| Sulfuric Acid SCHEMBL1491064 | 0.77 | CA1 (0.48) | CA12CA1CA2CA9CYP19A1 | |
| SCHEMBL30155019 | 0.74 | CA1 (0.51) | CA12CA1CA2CA9CYP19A1 | |
| SCHEMBL1650589 | 0.74 | CA1 (0.51) | CA12CA1CA2CA9CYP19A1 | |
| SCHEMBL29981560 | 0.72 | SLC7A5 (0.54) | HDAC1HDAC8USP2ALOX15NPSR1 | |
| SCHEMBL21219821 | 0.72 | SLC7A5 (0.54) | HDAC1HDAC8USP2ALOX15NPSR1 | |
| SCHEMBL5322017 | 0.72 | SLC7A5 (0.54) | HDAC1HDAC8USP2ALOX15NPSR1 | |
| SCHEMBL31370039 | 0.72 | SLC7A5 (0.54) | HDAC1HDAC8USP2ALOX15NPSR1 | |
| SCHEMBL9269708 | 0.72 | HDAC1 (0.51) | CA12CA1CA2CA9CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1228697-A | Method for in vivo reduction of iron levels and compositions useful therefor | MEDINOX INC (US) | 1999-09-15 | — | — | CN | disclosed |