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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 known ✓ | Q9Y5N1 | 9/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 SCHEMBL6588081 | 1.00 | KCNH2 (0.58) | KCNH2SIGMAR1HRH3MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7901429 | 0.81 | KCNH2 (0.63) | KCNH2 | |
| Hydrochloric Acid SCHEMBL7899758 | 0.77 | KCNH2 (0.58) | KCNH2HRH3 | |
| Hydrochloric Acid SCHEMBL6591801 | 0.73 | KCNH2 (0.65) | KCNH2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL7902768 | 0.68 | HRH3 (0.48) | KCNH2SIGMAR1HRH3 | |
| SCHEMBL4098379 | 0.66 | HRH3 (0.72) | KCNH2HRH3 | |
| SCHEMBL4098376 | 0.66 | HRH3 (0.72) | KCNH2HRH3 | |
| SCHEMBL28285426 | 0.66 | HRH3 (0.88) | HRH3MEN1KMT2A | |
| Maleic Acid SCHEMBL27342718 | 0.66 | MAP4K4 (0.50) | MEN1KMT2A | |
| Maleic Acid SCHEMBL27342717 | 0.66 | MAP4K4 (0.50) | MEN1KMT2A |
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-0781766-B1 | HETEROCYCLIC DERIVATIVE AND MEDICINE | NIPPON SHINYAKU CO LTD (JP) | 2004-03-31 | — | — | EP | disclosed |
| US-6191149-B1 | DRUG FOR CEREBROVASCULAR DISEASE | NIPPON SHINYAKU, CO., LTD. (JP) | 2001-02-20 | — | — | US | disclosed |
| US-5945426-A | PREVENT NEURONAL DEATH | NIPPON SHINYAKU CO., LTD. (JP) | 1999-08-31 | — | — | US | disclosed |
| EP-0781766-A1 | HETEROCYCLIC DERIVATIVE AND MEDICINE | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1997-07-02 | — | — | EP | disclosed |