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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | GGPS1 | O95749 | 6/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 8/20 | 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 SCHEMBL10384076 | 0.97 | CES2 (0.39) | CES2TSHRGGPS1THRATHRB | |
| Hydrochloric Acid SCHEMBL10384082 | 0.97 | CES2 (0.39) | CES2TSHRGGPS1THRATHRB | |
| Bromide SCHEMBL6416514 | 0.97 | CES2 (0.39) | CES2TSHRGGPS1THRATHRB | |
| Bromide SCHEMBL9510259 | 0.97 | CES2 (0.39) | CES2TSHRGGPS1THRATHRB | |
| SCHEMBL17360709 | 0.85 | CES2 (0.42) | CES2GGPS1MEN1MAPTKMT2A | |
| SCHEMBL372522 | 0.80 | CES2 (0.39) | CES2TSHRGGPS1THRATHRB | |
| Hydrochloric Acid SCHEMBL10383869 | 0.74 | ZDHHC20 (0.41) | CES2TSHRGGPS1THRATHRB | |
| Hydrochloric Acid SCHEMBL10384117 | 0.74 | ZDHHC20 (0.41) | CES2TSHRGGPS1THRATHRB | |
| Hydrochloric Acid SCHEMBL27634971 | 0.73 | TSHR (0.37) | CES2TSHRTHRATHRB | |
| Bromide SCHEMBL7914479 | 0.71 | TSHR (0.45) | CES2TSHRGGPS1THRATHRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120202912-A1 | SURFACE TREATMENT BY PHOTOPOLYMERISATION TO OBTAIN BIOCIDAL PROPERTIES | DESARROLLO DEL GRAFTING S.L. (ES) | 2012-08-09 | — | — | US | disclosed |
| US-20050095266-A1 | Surface treatment by photopolymerisation to obtain biocidal properties | DESARROLLO DEL GRAFTING S.L. (ES) | 2005-05-05 | — | — | US | disclosed |