Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C9 | P02748 | 3/20 | 0.80 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.80 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.80 |
| ▸ | APEX1 | P27695 | 2/20 | 0.80 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.80 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.80 |
| ▸ | CTH | P32929 | 2/20 | 0.80 |
| ▸ | MEN1 | O00255 | 2/20 | 0.80 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.80 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.80 |
| ▸ | IKBKB | O14920 | 1/20 | 0.80 |
| ▸ | RGS12 | O14924 | 1/20 | 0.80 |
| ▸ | GMNN | O75496 | 1/20 | 0.80 |
| ▸ | USP2 | O75604 | 1/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.80 |
| ▸ | MYC | P01106 | 1/20 | 0.80 |
| ▸ | LMNA | P02545 | 1/20 | 0.80 |
| ▸ | POLB | P06746 | 1/20 | 0.80 |
| ▸ | MAPT | P10636 | 1/20 | 0.80 |
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 | |
|---|---|---|---|---|
| Aurintricarboxylic Acid SCHEMBL98495 | 0.89 | MEN1 (1.00) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL29450069 | 0.89 | MEN1 (1.00) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL29353681 | 0.89 | MEN1 (1.00) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL515038 | 0.88 | MEN1 (0.97) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL15874321 | 0.88 | MEN1 (0.97) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL6158321 | 0.88 | MEN1 (0.97) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL30831678 | 0.88 | MEN1 (0.97) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL10791075 | 0.88 | MEN1 (0.97) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL29395768 | 0.88 | MEN1 (0.97) | C9CYP1A2CYP2D6CYP2C9APEX1 | |
| Aurintricarboxylic Acid SCHEMBL4644958 | 0.88 | MEN1 (0.97) | C9CYP1A2CYP2D6CYP2C9APEX1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991006589-A1 | NEW ANTI-HIV COMPOUNDS BELONGING TO AURINTRICARBOXYLIC ACID | THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, UNITED STATES DEPARTMENT OF COMMERCE (US) | 1991-05-16 | — | — | WO | disclosed |