Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Iodide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1F | P30939 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | BAZ2B | Q9UIF8 | 2/20 | 0.45 |
| ▸ | HTR1D | P28221 | 4/20 | 0.44 |
| ▸ | HTR1B | P28222 | 4/20 | 0.44 |
| ▸ | HTR6 | P50406 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL6963386 | 1.00 | HTR1F (0.54) | HTR1FMAPTSIRT1SLC6A4HSD17B10 | |
| SCHEMBL6964061 | 0.99 | HTR1F (0.55) | HTR1FMAPTSIRT1SLC6A4HSD17B10 | |
| Hydrochloric Acid SCHEMBL6959661 | 0.97 | HTR1F (0.54) | HTR1FMAPTSIRT1SLC6A4HSD17B10 | |
| Iodide SCHEMBL7660764 | 0.90 | SIRT1 (0.57) | HTR1FMAPTSIRT1SLC6A4HSD17B10 | |
| SCHEMBL7658403 | 0.88 | SIRT1 (0.58) | HTR1FMAPTSIRT1SLC6A4HSD17B10 | |
| SCHEMBL7662514 | 0.88 | SIRT1 (0.58) | HTR1FMAPTSIRT1SLC6A4HSD17B10 | |
| SCHEMBL7657746 | 0.88 | SIRT1 (0.58) | HTR1FMAPTSIRT1SLC6A4HSD17B10 | |
| SCHEMBL7403681 | 0.84 | HTR1F (0.56) | HTR1FSLC6A4HSD17B10BAZ2BHTR1D | |
| SCHEMBL7407128 | 0.83 | HTR1F (0.67) | HTR1FSLC6A4BAZ2BHTR1DHTR1B | |
| SCHEMBL6963427 | 0.83 | HTR1F (0.58) | HTR1FSIRT1HTR1DHTR1BKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0882726-B1 | Carbazol-carboxamides as 5-HT1F agonists | LILLY CO ELI (US) | 2003-05-21 | — | — | EP | disclosed |
| US-6221884-B1 | Carboxamides useful as 5-HT1F agonists | ELI LILLY AND COMPANY | 2001-04-24 | — | — | US | disclosed |
| EP-0882726-A1 | Carbazol-carboxamides as 5-HT1F agonists | ELI LILLY AND COMPANY (US) | 1998-12-09 | — | — | EP | disclosed |