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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL7445082 | 0.98 | ALDH1A1 (0.33) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL8135314 | 0.78 | EPHX1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL8130345 | 0.76 | EPHX1 (0.39) | — | |
| SCHEMBL18751250 | 0.73 | MEN1 (0.35) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL22810824 | 0.73 | — | — | |
| SCHEMBL8548799 | 0.72 | SMN1; SMN2 (0.40) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| Iodide SCHEMBL9259404 | 0.72 | ALDH1A1 (0.31) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| Iodide SCHEMBL9131259 | 0.72 | ALDH1A1 (0.31) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL9664023 | 0.71 | MEN1 (0.34) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL15739721 | 0.71 | MEN1 (0.34) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0145037-B1 | N-(BICYCLIC HETEROCYCLYL)-4-PIPERIDINAMINES | JANSSEN PHARMACEUTICA N.V. (BE) | 1989-01-18 | — | — | EP | disclosed |
| US-4634704-A | HISTAMINE AND SEROTONINE ANTAGONISTS | JANSSEN PHARMACEUTICA, N.V. (BE) | 1987-01-06 | — | — | US | disclosed |
| EP-0145037-A2 | N-(bicyclic heterocyclyl)-4-piperidinamines | JANSSEN PHARMACEUTICA N.V. (BE) | 1985-06-19 | — | — | EP | disclosed |