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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 16/20 | 0.40 |
| ▸ | F10 | P00742 | 14/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | PTPRF | P10586 | 1/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.35 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7354831 | 0.90 | F2 (0.42) | F2F10ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7353159 | 0.89 | F2 (0.40) | F2F10ITGB3ITGA2BPRSS1 | |
| Hydrochloric Acid SCHEMBL7360236 | 0.84 | F2 (0.41) | F2F10ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7360619 | 0.84 | F2 (0.51) | F2F10ITGB3ITGA2BPRSS1 | |
| SCHEMBL7353216 | 0.81 | F2 (0.58) | F2F10ITGB3ITGA2BPTPN1 | |
| Hydrochloric Acid SCHEMBL7353271 | 0.80 | F2 (0.44) | F2F10ITGB3ITGA2BPRSS1 | |
| Hydrochloric Acid SCHEMBL7363059 | 0.80 | F10 (0.39) | F2F10ITGB3ITGA2BPRSS1 | |
| Hydrochloric Acid SCHEMBL7355981 | 0.80 | F2 (0.46) | F2F10ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7354940 | 0.80 | F2 (0.46) | F2F10 | |
| Hydrochloric Acid SCHEMBL7352566 | 0.78 | F2 (0.51) | F2F10ITGB3ITGA2BPRSS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999028297-A1 | SUBSTITUTED INDOLES, HAVING A THROMBIN INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-06-10 | — | — | WO | disclosed |