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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 6/20 | 0.35 |
| ▸ | SLC6A4 known ✓ | P31645 | 4/20 | 0.35 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 3/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.31 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | OGG1 | O15527 | 1/20 | 0.30 |
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 SCHEMBL8038877 | 1.00 | SLC6A2 (0.35) | SLC6A2SLC6A4SLC6A3TAAR1PRKCI | |
| SCHEMBL8050768 | 0.91 | PRKCI (0.38) | PRKCIALDH1A1 | |
| SCHEMBL8049504 | 0.76 | PRKCI (0.37) | SLC6A2PRKCIALDH1A1 | |
| Hydrochloric Acid SCHEMBL8049679 | 0.75 | PRKCI (0.36) | SLC6A2PRKCIALDH1A1 | |
| SCHEMBL8051650 | 0.73 | PRKCI (0.32) | SLC6A2SLC6A4SLC6A3PRKCIPANK3 | |
| SCHEMBL8051666 | 0.72 | ALDH1A1 (0.37) | SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8051670 | 0.72 | LIMK1 (0.33) | SLC6A2SLC6A4SLC6A3PRKCIPANK3 | |
| Hydrochloric Acid SCHEMBL8054087 | 0.71 | ALDH1A1 (0.36) | SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8053422 | 0.69 | ROCK1 (0.35) | SLC6A2 | |
| Hydrochloric Acid SCHEMBL8053832 | 0.68 | ROCK1 (0.34) | SLC6A2 |
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 |