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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 6/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 7/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
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 SCHEMBL6979622 | 0.92 | F2 (0.39) | F2RORCPDK1PDK2PDK3 | |
| SCHEMBL7956920 | 0.91 | F2 (0.46) | F2ROCK2P2RX7RORCNR3C1 | |
| SCHEMBL6982826 | 0.90 | P2RX7 (0.41) | ROCK2P2RX7RORCNR3C1PARP1 | |
| SCHEMBL7958921 | 0.88 | F2 (0.52) | F2PDK1PDK2PDK3PDK4 | |
| SCHEMBL6978633 | 0.84 | RORC (0.36) | RORCPDK1PDK2PDK3PDK4 | |
| SCHEMBL6985778 | 0.84 | NR3C1 (0.43) | F2PDK1PDK2PDK3PDK4 | |
| SCHEMBL7958935 | 0.83 | F10 (0.41) | F2RORCPDK1PDK2PDK3 | |
| SCHEMBL6978671 | 0.83 | F2 (0.46) | F2RORCNR3C1PARP1 | |
| SCHEMBL6978636 | 0.81 | PDK1 (0.36) | RORCPDK1PDK2PDK3PDK4 | |
| Iodide SCHEMBL7960633 | 0.81 | F2 (0.41) | F2PDK1PDK2PDK3PDK4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6300342-B1 | FOR THERAPY OR INHIBITING THROMBUS FORMATION; FOR THERAPY OF FIBRIN-DEPENDENT INFLAMMATORY CONDITION | BOEHRINGER INGELHEIM PHARM KG (DE) | 2001-10-09 | — | — | US | disclosed |