Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol
The experimentally established mechanism targets of Maleic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D known ✓ | P25100 | 12/20 | 0.44 |
| ▸ | ADRA1A known ✓ | P35348 | 12/20 | 0.44 |
| ▸ | ADRA1B known ✓ | P35368 | 2/20 | 0.41 |
| ▸ | HTR1A known ✓ | P08908 | 3/20 | 0.40 |
| ▸ | DRD2 known ✓ | P14416 | 3/20 | 0.40 |
| ▸ | HTR7 | P34969 | 3/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL5329684 | 1.00 | ADRA1D (0.44) | ADRA1DADRA1AADRA1BHTR1ADRD2 | |
| SCHEMBL4530520 | 0.94 | ADRA1D (0.46) | ADRA1DADRA1AADRA1BHTR1ADRD2 | |
| Hydrochloric Acid SCHEMBL4522464 | 0.93 | ADRA1D (0.45) | ADRA1DADRA1AADRA1BHTR1ADRD2 | |
| Succinic Acid SCHEMBL5328546 | 0.92 | ADRA1D (0.44) | ADRA1DADRA1AADRA1BHTR1ADRD2 | |
| Cadaverine Tartrate SCHEMBL5330974 | 0.92 | ADRA1D (0.44) | ADRA1DADRA1AADRA1BHTR1ADRD2 | |
| Phosphoric Acid SCHEMBL5327007 | 0.91 | ADRA1D (0.45) | ADRA1DADRA1AADRA1BHTR1ADRD2 | |
| Fumaric Acid SCHEMBL5325185 | 0.87 | ADRA1D (0.42) | ADRA1DADRA1AADRA1BDRD2 | |
| Fumaric Acid SCHEMBL5325595 | 0.87 | DRD2 (0.44) | ADRA1DADRA1AADRA1BHTR1ADRD2 | |
| Maleic Acid SCHEMBL5325181 | 0.87 | ADRA1D (0.42) | ADRA1DADRA1AADRA1BDRD2 | |
| Maleic Acid SCHEMBL5331109 | 0.87 | DRD2 (0.44) | ADRA1DADRA1AADRA1BHTR1ADRD2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007012761-A1 | NOVEL POLYSUBSTITUTED 1,1-PYRIDINYL AMINOCYCLOPROPANAMINE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | LES LABORATOIRES SERVIER (FR) | 2007-02-01 | — | — | WO | disclosed |
| WO-2007010504-A2 | ACID ADDITION SALTS OF ISOINDOLES ACTING AS ADRENERGIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2007-01-25 | — | — | WO | disclosed |