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 | |
|---|---|---|---|---|
| ▸ | PIK3CG | P48736 | 6/20 | 0.70 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.70 |
| ▸ | PIK3CB | P42338 | 5/20 | 0.70 |
| ▸ | MEN1 | O00255 | 4/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.66 |
| ▸ | IKBKB | O14920 | 3/20 | 0.63 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.61 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | CHUK | O15111 | 1/20 | 0.53 |
| ▸ | CDK2 | P24941 | 1/20 | 0.52 |
| ▸ | AKT1 | P31749 | 1/20 | 0.52 |
| ▸ | KDR | P35968 | 1/20 | 0.52 |
| ▸ | PLK1 | P53350 | 1/20 | 0.52 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7464281 | 1.00 | PIK3CG (0.70) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL7465398 | 0.85 | PIK3CG (0.76) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL4736128 | 0.83 | PIK3CG (0.76) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL10977837 | 0.82 | PIK3CG (0.78) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL7474268 | 0.81 | PIK3CA (0.65) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL7466239 | 0.79 | ACVR1 (0.72) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL4385401 | 0.79 | JAK2 (0.76) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL4738430 | 0.78 | PIK3CG (0.69) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL3520678 | 0.78 | IKBKB (1.00) | PIK3CGPIK3CAPIK3CBMEN1KMT2A | |
| SCHEMBL13924506 | 0.76 | SYK (0.79) | PIK3CGPIK3CAPIK3CBMEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0233461-B2 | 4,5,6-Substituted-2-pyrimidinamines | AMERICAN CYANAMID CO (US) | 2002-05-29 | — | — | EP | disclosed |
| EP-0233461-B1 | 4,5,6-Substituted-2-pyrimidinamines | AMERICAN CYANAMID CO (US) | 1996-03-20 | — | — | EP | disclosed |
| US-4876252-A | ADMINISTERING ANTIASTHMATIC OR ANTIALLERGEN | AMERICAN CYANAMID COMPANY (US) | 1989-10-24 | — | — | US | disclosed |
| US-4788195-A | TREATING ASTHMA, ALLERGIC DISEASES, INFLAMMATION AND DIABETES IN MAMMALS | AMERICAN CYANAMID COMPANY (US) | 1988-11-29 | — | — | US | disclosed |
| EP-0233461-A2 | 4,5,6-Substituted-2-pyrimidinamines | AMERICAN CYANAMID COMPANY (US) | 1987-08-26 | — | — | EP | disclosed |