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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 6/20 | 0.54 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 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 SCHEMBL8049585 | 1.00 | TDO2 (0.54) | TDO2HTR6IDO1CYP1A2CYP3A4 | |
| SCHEMBL8056408 | 0.89 | TDO2 (0.48) | TDO2IDO1CYP1A2CYP3A4CYP2C8 | |
| Maleic Acid SCHEMBL7344422 | 0.83 | SLC6A2 (0.50) | HTR6ALDH1A1 | |
| Fumaric Acid SCHEMBL7344425 | 0.83 | SLC6A2 (0.50) | HTR6ALDH1A1 | |
| Fumaric Acid SCHEMBL7336541 | 0.76 | HTT (0.40) | TDO2CYP1A2CYP3A4CYP2C8TGFBR1 | |
| Maleic Acid SCHEMBL7336533 | 0.76 | HTT (0.40) | TDO2CYP1A2CYP3A4CYP2C8TGFBR1 | |
| SCHEMBL31744753 | 0.72 | GPR84 (0.45) | TDO2IDO1 | |
| SCHEMBL8049566 | 0.72 | TGFBR1 (0.46) | TDO2CYP1A2CYP3A4CYP2C8TGFBR1 | |
| SCHEMBL8051654 | 0.72 | KIF11 (0.47) | CYP1A2ALDH1A1 | |
| SCHEMBL19178919 | 0.71 | TDO2 (1.00) | TDO2IDO1HTTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6022880-A | Substituted pyridylamino indoles | HOECHST MARION ROUSSEL, INC. (US) | 2000-02-08 | — | — | US | disclosed |
| US-5328920-A | Alleviating memory dysfunctions | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-07-12 | — | — | US | disclosed |