Known targets — ChEMBL curated mechanism
ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol
The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 4/20 | 0.47 |
| ▸ | HTR2C known ✓ | P28335 | 4/20 | 0.47 |
| ▸ | HTR2B known ✓ | P41595 | 2/20 | 0.47 |
| ▸ | HTR1A | P08908 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.47 |
| ▸ | HTR1D | P28221 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 1/20 | 0.47 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.44 |
| ▸ | BLM | P54132 | 2/20 | 0.44 |
| ▸ | KMO | O15229 | 1/20 | 0.42 |
| ▸ | SLC22A12 | Q96S37 | 10/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
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 SCHEMBL4845619 | 1.00 | HTR2A (0.47) | HTR2AHTR2CHTR1AADRA2AADRA2B | |
| SCHEMBL3136016 | 0.90 | HTR2A (0.56) | HTR2AHTR2CHTR1AADRA2AADRA2B | |
| Fumaric Acid SCHEMBL6361127 | 0.87 | HTR2A (0.46) | HTR2AHTR2CHTR1AADRA2AADRA2B | |
| Fumaric Acid SCHEMBL6361122 | 0.87 | HTR2A (0.46) | HTR2AHTR2CHTR1AADRA2AADRA2B | |
| Fumaric Acid SCHEMBL7098345 | 0.87 | HTR2C (0.40) | HTR2AHTR2CHTR1AADRA2AADRA2B | |
| Fumaric Acid SCHEMBL7098346 | 0.87 | HTR2C (0.40) | HTR2AHTR2CHTR1AADRA2AADRA2B | |
| Fumaric Acid SCHEMBL6364123 | 0.85 | HTR2C (0.48) | HTR2AHTR2CHTR2BKMOSLC22A12 | |
| Fumaric Acid SCHEMBL6364117 | 0.85 | HTR2C (0.48) | HTR2AHTR2CHTR2BKMOSLC22A12 | |
| Fumaric Acid SCHEMBL5678095 | 0.85 | HTR2C (0.48) | HTR2AHTR2CHTR2BKMOSLC22A12 | |
| Fumaric Acid SCHEMBL5678109 | 0.85 | HTR2C (0.48) | HTR2AHTR2CHTR2BKMOSLC22A12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008027341-A2 | TOPICAL OPHTHALMIC FORMULATIONS | MERCK & CO., INC. (US) | 2008-03-06 | — | — | WO | disclosed |
| US-6956036-B1 | 6-hydroxy-indazole derivatives for treating glaucoma | ALCON, INC. (CH) | 2005-10-18 | — | — | US | disclosed |