Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | MITF | O75030 | 1/20 | 0.49 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | JAK1 | P23458 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11122026 | 0.84 | CA12 (0.73) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL11274121 | 0.78 | HDAC3 (0.53) | MITFKLF5HDAC3HDAC11HDAC8 | |
| SCHEMBL8518202 | 0.78 | CA12 (0.65) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL9818903 | 0.76 | CA12 (0.63) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL9206404 | 0.76 | CA12 (0.63) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL9819019 | 0.76 | KMT2A (0.66) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL15651789 | 0.76 | CA1 (0.68) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL6318825 | 0.76 | POLB (0.66) | CA12CA1CA2CA9HDAC3 | |
| SCHEMBL8626883 | 0.76 | CA12 (0.63) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL1618221 | 0.76 | ALDH1A1 (0.64) | CA12CA1CA2CA9CYP1A2 |
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-4348396-A | Substituted 11-oxo-11H-pyrido[2,1-b]quinazolines and method of inhibiting allergic reactions with them | HOFFMANN-LA ROCHE INC. (US) | 1982-09-07 | — | — | US | disclosed |