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 | |
|---|---|---|---|---|
| ▸ | DRD2 known ✓ | P14416 | 10/20 | 0.50 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.50 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.55 |
| ▸ | DRD3 | P35462 | 10/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22728542 | 0.88 | DRD2 (0.63) | NOTUMDRD2DRD3ADRB1DRD4 | |
| SCHEMBL29732498 | 0.88 | DRD2 (0.63) | NOTUMDRD2DRD3ADRB1DRD4 | |
| Maleic Acid SCHEMBL22721113 | 0.87 | NOTUM (0.51) | NOTUMDRD2DRD3ADRB1OPRK1 | |
| Hydrochloric Acid SCHEMBL29732476 | 0.87 | DRD2 (0.61) | NOTUMDRD2DRD3ADRB1DRD4 | |
| Hydrochloric Acid SCHEMBL22721060 | 0.87 | DRD2 (0.61) | NOTUMDRD2DRD3ADRB1DRD4 | |
| SCHEMBL6507356 | 0.77 | NOTUM (0.83) | NOTUMDRD2DRD3ADRB1OPRK1 | |
| SCHEMBL31381185 | 0.77 | NOTUM (0.83) | NOTUMDRD2DRD3ADRB1OPRK1 | |
| Maleic Acid SCHEMBL22721163 | 0.76 | DRD2 (0.43) | DRD2 | |
| Maleic Acid SCHEMBL22720999 | 0.76 | HTR1A (0.41) | DRD2OPRK1 | |
| SCHEMBL22728573 | 0.73 | DRD2 (0.57) | NOTUMDRD2DRD3ADRB1DRD4 |
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-2020239073-A1 | FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海药物研究所 | 2020-12-03 | — | — | WO | disclosed |