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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 4/20 | 0.53 |
| ▸ | ATXN2 | Q99700 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23704607 | 0.86 | SMN1; SMN2 (0.55) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL16616151 | 0.85 | SMN1; SMN2 (0.54) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL30553394 | 0.85 | SMN1; SMN2 (0.64) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL27194502 | 0.83 | ENPP2 (0.52) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL25326302 | 0.82 | SMN1; SMN2 (0.53) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL25324994 | 0.81 | SMN1; SMN2 (0.56) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL27194552 | 0.80 | ENPP2 (0.49) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL25697332 | 0.80 | ENPP2 (0.57) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL25486481 | 0.79 | MEN1 (0.61) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3551987 | 0.79 | MEN1 (0.54) | ENPP2ATXN2SMN1; SMN2NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115210235-A | 1H-pyrazolo [4,3-d ] pyrimidine compounds as Toll-like receptor 7 (TLR 7) agonists | 百时美施贵宝公司 | 2022-10-18 | — | — | CN | disclosed |