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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 3/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL706693 | 0.98 | ALOX5 (0.37) | ALOX5APPADRB2 | |
| SCHEMBL16088989 | 0.79 | ALOX5 (0.55) | ALOX5 | |
| SCHEMBL30766000 | 0.79 | ALOX5 (0.55) | ALOX5 | |
| SCHEMBL506674 | 0.79 | ALOX5 (0.55) | ALOX5 | |
| SCHEMBL14074679 | 0.77 | ALOX5 (0.35) | ALOX5APP | |
| SCHEMBL17616984 | 0.77 | ALOX5 (0.35) | ALOX5APP | |
| Hydrochloric Acid SCHEMBL30765894 | 0.77 | ALOX5 (0.54) | ALOX5 | |
| SCHEMBL19292503 | 0.76 | APP (0.57) | ALOX5APP | |
| SCHEMBL13010802 | 0.75 | ADRB2 (0.32) | ADRB2 | |
| SCHEMBL12261660 | 0.73 | — | — |
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-1122291-B1 | Layered organic-inorganic perovskites having metal-deficient inorganic frameworks | IBM (US) | 2012-09-12 | — | — | EP | claimed |
| US-6429318-B1 | METAL HALIDE LAYER AND HYDROGEN HALIDE SALT OF ORGANIC DIAMINE ARE CONTACTED; SALT FORMATION, SUPERSATURATION, PRECIPITATION | INTERNATIONAL BUSINESS MACHINES CORPORAITON | 2002-08-06 | — | — | US | claimed |
| EP-1122291-B1 | Layered organic-inorganic perovskites having metal-deficient inorganic frameworks | IBM (US) | 2012-09-12 | — | — | EP | disclosed |
| US-6429318-B1 | METAL HALIDE LAYER AND HYDROGEN HALIDE SALT OF ORGANIC DIAMINE ARE CONTACTED; SALT FORMATION, SUPERSATURATION, PRECIPITATION | INTERNATIONAL BUSINESS MACHINES CORPORAITON | 2002-08-06 | — | — | US | disclosed |
| EP-1122291-A2 | Layered organic-inorganic perovskites having metal-deficient inorganic frameworks | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2001-08-08 | — | — | EP | disclosed |