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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | GRM8 | O00222 | 10/20 | 0.46 |
| ▸ | GRM4 | Q14833 | 10/20 | 0.46 |
| ▸ | GRM6 | O15303 | 5/20 | 0.46 |
| ▸ | PTPRA | P18433 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL639675 | 0.99 | KMO (0.50) | KMOALDH1A1CYP3A4ALOX15TDP1 | |
| SCHEMBL465890 | 0.99 | KMO (0.50) | KMOALDH1A1CYP3A4ALOX15TDP1 | |
| SCHEMBL9543018 | 0.99 | KMO (0.50) | KMOALDH1A1CYP3A4ALOX15TDP1 | |
| Hydrochloric Acid SCHEMBL11310889 | 0.97 | KMO (0.49) | KMOALDH1A1CYP3A4ALOX15TDP1 | |
| Bromide SCHEMBL10946974 | 0.97 | KMO (0.49) | KMOALDH1A1CYP3A4ALOX15TDP1 | |
| Water SCHEMBL6282445 | 0.97 | KMO (0.49) | KMOALDH1A1CYP3A4ALOX15TDP1 | |
| Hydrochloric Acid SCHEMBL10950905 | 0.97 | KMO (0.49) | KMOALDH1A1CYP3A4ALOX15TDP1 | |
| SCHEMBL10613892 | 0.80 | KMT2A (0.50) | ALDH1A1CYP3A4ALOX15TDP1GRM8 | |
| 4-Nitroaniline SCHEMBL10698315 | 0.80 | CCR2 (0.38) | KMOGRM8GRM4GRM6GAA | |
| SCHEMBL4414897 | 0.79 | KMT2A (0.44) | ALDH1A1CYP3A4ALOX15TDP1GRM8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4567138-A | Method for determining γ-glutamyltransferase activity and kits containing a novel substrate solution for use therein | BECKMAN INSTRUMENTS, INC. (US) | 1986-01-28 | — | — | US | claimed |
| EP-0118534-A1 | METHOD FOR DETERMINING -g(g)-GLUTAMYLTRANSFERASE ACTIVITY AND KITS CONTAINING A NOVEL SUBSTRATE SOLUTION FOR USE THEREIN. | BECKMAN INSTRUMENTS INC (US) | 1984-09-19 | — | — | EP | claimed |
| WO-1984000978-A1 | METHOD FOR DETERMINING gamma-GLUTAMYLTRANSFERASE ACTIVITY AND KITS CONTAINING A NOVEL SUBSTRATE SOLUTION FOR USE THEREIN | BECKMAN INSTRUMENTS INC (US) | 1984-03-15 | — | — | WO | claimed |