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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 6/20 | 0.46 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.44 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.44 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.44 |
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 SCHEMBL9424668 | 1.00 | SMN1; SMN2 (0.57) | SMN1; SMN2LMNAALDH1A1KMT2AL3MBTL1 | |
| Iodide SCHEMBL9424032 | 0.89 | SMN1; SMN2 (0.53) | SMN1; SMN2LMNAALDH1A1KMT2AL3MBTL1 | |
| Iodide SCHEMBL9424035 | 0.89 | SMN1; SMN2 (0.53) | SMN1; SMN2LMNAALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL9424126 | 0.87 | SMN1; SMN2 (0.54) | SMN1; SMN2LMNAALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL9424125 | 0.87 | SMN1; SMN2 (0.54) | SMN1; SMN2LMNAALDH1A1KMT2AL3MBTL1 | |
| Iodide SCHEMBL9424504 | 0.85 | NPC1 (0.48) | SMN1; SMN2LMNAALDH1A1L3MBTL1RECQL | |
| Iodide SCHEMBL9424500 | 0.85 | NPC1 (0.48) | SMN1; SMN2LMNAALDH1A1L3MBTL1RECQL | |
| Iodide SCHEMBL9060578 | 0.84 | SCN9A (0.44) | SMN1; SMN2LMNAALDH1A1KMT2AMEN1 | |
| Iodide SCHEMBL9060574 | 0.84 | SCN9A (0.44) | SMN1; SMN2LMNAALDH1A1KMT2AMEN1 | |
| Iodide SCHEMBL9423859 | 0.82 | ALDH1A1 (0.52) | SMN1; SMN2LMNAALDH1A1KMT2AL3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5373008-A | Phenylamidine and phenylguanidine derivatives and their use as anti-diabetic agents | THE BOOTS COMPANT PLC. (GB) | 1994-12-13 | — | — | US | disclosed |
| US-5223498-A | Hypoglycemic agents | THE BOOTS COMPANY PLC (GB) | 1993-06-29 | — | — | US | disclosed |
| EP-0385038-B1 | ORTHO-SUBSTITUTED PHENYL AMIDINE AND PHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM | The Boots Company PLC (GB) | 1993-06-02 | — | — | EP | disclosed |
| EP-0385038-A1 | Ortho-substituted phenyl amidine and phenyl guanidine derivatives and antidiabetic or hypoglycaemic agents containing them | The Boots Company PLC (GB) | 1990-09-05 | — | — | EP | disclosed |