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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | ATP4A | P20648 | 3/20 | 0.33 |
| ▸ | ATP4B | P51164 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL11268956 | 1.00 | CYP3A4 (0.40) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| SCHEMBL11242827 | 0.92 | HRH2 (0.45) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| SCHEMBL11254232 | 0.92 | HRH2 (0.45) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| Hydrochloric Acid SCHEMBL11261622 | 0.91 | HRH2 (0.44) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| Hydrochloric Acid SCHEMBL11261618 | 0.91 | HRH2 (0.44) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| Tiotidine SCHEMBL11253081 | 0.89 | CYP3A4 (0.43) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| Tiotidine SCHEMBL11253090 | 0.89 | CYP3A4 (0.43) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| Maleic Acid SCHEMBL11251056 | 0.88 | MAPT (0.42) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| Maleic Acid SCHEMBL11251053 | 0.88 | MAPT (0.42) | CYP3A4CYP2D6MAPTHRH2ACHE | |
| Maleic Acid SCHEMBL11252796 | 0.87 | CYP3A4 (0.42) | CYP3A4CYP2D6MAPTHRH2ACHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4347370-A | HISTAMINE H-2 ANTAGONISTS, INHIBIT GASTRIC ACID SECRETION | IMPERIAL CHEMICAL INDUSTRIES LTD. (GB) | 1982-08-31 | — | — | US | disclosed |
| US-4262126-A | INHIBIT SECRETION OF GASTRIC JUICE | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1981-04-14 | — | — | US | disclosed |
| US-4165378-A | ANTISECRETORY, ANTIHISTAMINE | ICI AMERICAS INC. (US) | 1979-08-21 | — | — | US | disclosed |