Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Aurintricarboxylic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.95 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.95 |
| ▸ | C9 | P02748 | 3/20 | 0.95 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.95 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.95 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.95 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.95 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.95 |
| ▸ | APEX1 | P27695 | 2/20 | 0.95 |
| ▸ | CTH | P32929 | 2/20 | 0.95 |
| ▸ | POLB | P06746 | 2/20 | 0.95 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.95 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.95 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.95 |
| ▸ | THRB | P10828 | 2/20 | 0.95 |
| ▸ | HPGD | P15428 | 2/20 | 0.95 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.95 |
| ▸ | BRCA1 | P38398 | 2/20 | 0.95 |
| ▸ | RECQL | P46063 | 2/20 | 0.95 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.95 |
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 SCHEMBL29450069 | 0.97 | MEN1 (1.00) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL98495 | 0.97 | MEN1 (1.00) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL29353681 | 0.97 | MEN1 (1.00) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL6158321 | 0.96 | MEN1 (0.97) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL29395768 | 0.96 | MEN1 (0.97) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL30831678 | 0.96 | MEN1 (0.97) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL4644958 | 0.96 | MEN1 (0.97) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL10791075 | 0.96 | MEN1 (0.97) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL515038 | 0.96 | MEN1 (0.97) | MEN1KMT2AC9CYP2C9CYP2C19 | |
| Aurintricarboxylic Acid SCHEMBL15874321 | 0.96 | MEN1 (0.97) | MEN1KMT2AC9CYP2C9CYP2C19 |
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-2004015089-A2 | POLYIONIC ORGANIC ACID FORMULATIONS | GENTERIC, INC. (US) | 2004-02-19 | — | — | WO | disclosed |