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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.38 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | NPY2R | P49146 | 1/20 | 0.34 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9847039 | 0.94 | LMNA (0.42) | TOP2AALDH1A1LMNAPLA2G1BSMN1; SMN2 | |
| SCHEMBL9846967 | 0.74 | TOP2A (0.44) | TOP2AALDH1A1LMNAPLA2G1BSMN1; SMN2 | |
| SCHEMBL9659435 | 0.72 | ALDH1A1 (0.45) | ALDH1A1LMNAPLA2G1BSMN1; SMN2ATG4B | |
| SCHEMBL10517984 | 0.71 | ALDH1A1 (0.51) | ALDH1A1LMNAPLA2G1BSMN1; SMN2ATG4B | |
| Fumaric Acid SCHEMBL9847012 | 0.71 | ALDH1A1 (0.38) | ALDH1A1LMNAPLA2G1BSMN1; SMN2ATG4B | |
| SCHEMBL9846964 | 0.71 | TOP2A (0.53) | TOP2ALMNASMN1; SMN2RAB9AKDM4E | |
| SCHEMBL2209111 | 0.70 | ALDH1A1 (0.49) | ALDH1A1LMNAPLA2G1BSMN1; SMN2ATG4B | |
| SCHEMBL9846989 | 0.69 | TOP2A (0.43) | TOP2AALDH1A1LMNARAB9AKDM4E | |
| SCHEMBL23628473 | 0.65 | CETP (0.47) | TOP2AALDH1A1LMNASMN1; SMN2RAB9A | |
| Fumaric Acid SCHEMBL9206422 | 0.64 | TSHR (0.44) | ALDH1A1LMNASMN1; SMN2PDK1PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0435222-A2 | Aminopyridinylmethanols and aminomethylpyridinamines and related compounds, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-07-03 | — | — | EP | disclosed |