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 | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.52 |
| ▸ | GSK3A | P49840 | 19/20 | 0.50 |
| ▸ | GSK3B | P49841 | 19/20 | 0.50 |
| ▸ | CDK1 | P06493 | 18/20 | 0.50 |
| ▸ | CCNB2 | O95067 | 17/20 | 0.50 |
| ▸ | CCNB1 | P14635 | 17/20 | 0.50 |
| ▸ | CCNB3 | Q8WWL7 | 17/20 | 0.50 |
| ▸ | CDK5 | Q00535 | 10/20 | 0.50 |
| ▸ | CDK5R1 | Q15078 | 9/20 | 0.50 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.49 |
| ▸ | CDK2 | P24941 | 3/20 | 0.49 |
| ▸ | AURKA | O14965 | 2/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.49 |
| ▸ | PAK4 | O96013 | 2/20 | 0.49 |
| ▸ | ABL1 | P00519 | 2/20 | 0.49 |
| ▸ | FYN | P06241 | 2/20 | 0.49 |
| ▸ | RET | P07949 | 2/20 | 0.49 |
| ▸ | KDR | P35968 | 2/20 | 0.49 |
| ▸ | CDK8 | P49336 | 2/20 | 0.49 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.49 |
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 SCHEMBL1777519 | 0.86 | GSK3A (0.63) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL7649461 | 0.85 | GSK3A (0.65) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL5618949 | 0.84 | GSK3A (0.60) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL1779435 | 0.84 | GSK3A (0.69) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL6852377 | 0.81 | GSK3A (0.58) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL1778365 | 0.81 | GSK3A (0.52) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL5618955 | 0.80 | MAPK14 (0.53) | MAPK14GSK3AGSK3BCDK1CCNB2 | |
| SCHEMBL1778473 | 0.74 | GSK3A (0.54) | MAPK14GSK3AGSK3BCDK1CCNB2 | |
| SCHEMBL1777073 | 0.74 | GSK3A (0.54) | MAPK14GSK3AGSK3BCDK1CCNB2 | |
| SCHEMBL27594647 | 0.72 | MAPK14 (0.61) | MAPK14GSK3AGSK3BCDK1CCNB2 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1990343-B1 | Azaindoles | AVENTIS PHARMA LTD (GB) | 2012-04-04 | — | — | EP | disclosed |
| US-7943616-B2 | Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders | AVENTIS PHARMACEUTICALS INC. (US) | 2011-05-17 | — | — | US | disclosed |
| EP-2233486-A1 | Azaindoles | Aventis Pharma Limited (GB) | 2010-09-29 | — | — | EP | disclosed |
| EP-1990343-A2 | Azaindoles | Aventis Pharma Limited (GB) | 2008-11-12 | — | — | EP | disclosed |
| US-7227020-B2 | Azaindoles | AVENTIS PHARMA LIMITED (GB) | 2007-06-05 | — | — | US | disclosed |
| US-20050267304-A1 | Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders | AVENTIS PHARMACEUTICALS INC. (US) | 2005-12-01 | — | — | US | disclosed |
| US-6897207-B2 | Azaindoles | AVENTIS PHARMACEUTICALS INC. (US) | 2005-05-24 | — | — | US | disclosed |
| US-20040198737-A1 | Azaindoles | AVENTIS PHARMA LIMITED (GB) | 2004-10-07 | — | — | US | disclosed |
| US-6770643-B2 | Azaindoles | AVENTIS PHARMA LIMITED (GB) | 2004-08-03 | — | — | US | disclosed |
| US-20040053931-A1 | Azaindoles | AVENTIS PHARMACEUTICALS INC. | 2004-03-18 | — | — | US | disclosed |
| EP-1397360-A1 | AZAINDOLES | Aventis Pharma Limited (GB) | 2004-03-17 | — | — | EP | disclosed |
| US-20040009983-A1 | Azaindoles | AVENTIS PHARMA LIMITED (GB) | 2004-01-15 | — | — | US | disclosed |
| WO-2003000688-A1 | AZAINDOLES | AVENTIS PHARMA LIMITED (GB) | 2003-01-03 | — | — | WO | disclosed |
| EP-1263759-A2 | AZAINDOLES | Aventis Pharma Limited (GB) | 2002-12-11 | — | — | EP | disclosed |
| WO-2001047922-A2 | AZAINDOLES | AVENTIS PHARMA LIMITED (GB) | 2001-07-05 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20040198737-A1 | Azaindoles | CCNY, CCNO, CNKSR1 | MAPK14 460/4885GSK3A 681/4885GSK3B 805/4885 |
| US-20040053931-A1 | Azaindoles | CDKN1A, CDK7, CDK2 | MAPK14 139/4885GSK3A 456/4885GSK3B 409/4885 |
| US-20040009983-A1 | Azaindoles | CCNY, CCNO, CKS2 | MAPK14 762/4885GSK3A 1039/4885GSK3B 1166/4885 |
| US-20050267304-A1 | Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders | MAP3K20, MAP3K12, MAP3K19 | MAPK14 55/4885GSK3A 176/4885GSK3B 187/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.