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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 9/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP24A1 | Q07973 | 5/20 | 0.37 |
| ▸ | CYP27B1 | O15528 | 2/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
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 SCHEMBL10464858 | 1.00 | CYP17A1 (0.42) | CYP17A1CYP3A4CYP19A1CYP24A1CYP27B1 | |
| Maleic Acid SCHEMBL9689410 | 0.85 | CYP17A1 (0.37) | CYP17A1CYP3A4CYP19A1CYP24A1FAAH | |
| Fumaric Acid SCHEMBL10576020 | 0.85 | CYP17A1 (0.37) | CYP17A1CYP3A4CYP19A1CYP24A1FAAH | |
| Benzo[D]Isoxazole SCHEMBL10466496 | 0.77 | CYP24A1 (0.37) | CYP17A1CYP19A1CYP24A1CYP27B1 | |
| Benzo[D]Isoxazole SCHEMBL10466494 | 0.77 | CYP24A1 (0.37) | CYP17A1CYP19A1CYP24A1CYP27B1 | |
| Zoniclezole SCHEMBL1404104 | 0.76 | CYP19A1 (0.41) | CYP17A1CYP3A4CYP19A1FAAH | |
| Zoniclezole SCHEMBL634986 | 0.75 | CYP19A1 (0.40) | CYP17A1CYP3A4CYP19A1FAAH | |
| SCHEMBL10464807 | 0.75 | CYP17A1 (0.51) | CYP17A1CYP3A4 | |
| SCHEMBL10516667 | 0.74 | CYP17A1 (0.40) | CYP17A1CYP3A4CYP19A1FAAH | |
| SCHEMBL10575254 | 0.69 | CYP17A1 (0.44) | CYP17A1CYP3A4CYP19A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0298921-B1 | 1,2-BENZISOXAZOLES AND 1,2-BENZISOTHIAZOLES | CIBA-GEIGY AG (CH) | 1992-12-23 | — | — | EP | disclosed |
| US-4957931-A | ANTICONVULSANTS, TREATMENT OF EPILEPSY | CIBA-GEIGY CORPORATION (US) | 1990-09-18 | — | — | US | disclosed |
| US-4859691-A | Certain 1,2-benzisoxazole derivatives | CIBA-GEIGY CORPORATION (US) | 1989-08-22 | — | — | US | disclosed |
| EP-0298921-A1 | 1,2-Benzisoxazoles and 1,2-benzisothiazoles | CIBA-GEIGY AG (CH) | 1989-01-11 | — | — | EP | disclosed |