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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 2/20 | 0.65 |
| ▸ | NOS2 | P35228 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 SCHEMBL7316884 | 1.00 | SLC6A9 (0.65) | SLC6A9NOS2LMNAALDH1A1CYP3A4 | |
| Fumaric Acid SCHEMBL7315531 | 0.86 | SLC6A9 (0.64) | SLC6A9NOS2LMNAALDH1A1CYP3A4 | |
| Maleic Acid SCHEMBL7315527 | 0.86 | SLC6A9 (0.64) | SLC6A9NOS2LMNAALDH1A1CYP3A4 | |
| Maleic Acid SCHEMBL7311827 | 0.83 | SLC6A2 (0.56) | SLC6A9NOS2LMNAALDH1A1CYP3A4 | |
| Fumaric Acid SCHEMBL11354089 | 0.81 | SLC6A9 (0.47) | SLC6A9NOS2LMNAALDH1A1CYP3A4 | |
| Fumaric Acid SCHEMBL11354087 | 0.81 | SLC6A9 (0.47) | SLC6A9NOS2LMNAALDH1A1CYP3A4 | |
| Fumaric Acid SCHEMBL7311088 | 0.81 | SLC6A9 (0.60) | SLC6A9ALDH1A1CYP2C19 | |
| Maleic Acid SCHEMBL7311084 | 0.81 | SLC6A9 (0.60) | SLC6A9ALDH1A1CYP2C19 | |
| Fumaric Acid SCHEMBL7319213 | 0.79 | SLC6A9 (0.64) | SLC6A9 | |
| Maleic Acid SCHEMBL7319208 | 0.79 | SLC6A9 (0.64) | SLC6A9 |
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 |
|---|---|---|---|---|---|---|---|
| US-4626549-A | Treatment of obesity with aryloxyphenylpropylamines | ELI LILLY AND COMPANY (US) | 1986-12-02 | — | — | US | disclosed |
| US-4314081-A | ANTIDEPRESSANTS | ELI LILLY AND COMPANY (US) | 1982-02-02 | — | — | US | disclosed |
| US-4194009-A | ANTIDEPRESSANT | ELI LILLY AND COMPANY (US) | 1980-03-18 | — | — | US | disclosed |
| US-4018895-A | Aryloxyphenylpropylamines in treating depression | ELI LILLY AND COMPANY (US) | 1977-04-19 | — | — | US | disclosed |