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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.67 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.67 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.67 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.67 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.67 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.67 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.67 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.63 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | NAMPT | P43490 | 1/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.59 |
| ▸ | NAAA | Q02083 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL9941474 | 0.98 | SMN1; SMN2 (0.70) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL20340796 | 0.98 | SMN1; SMN2 (0.70) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8044895 | 0.98 | SMN1; SMN2 (0.70) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL14786047 | 0.98 | SMN1; SMN2 (0.70) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9095557 | 0.98 | SMN1; SMN2 (0.70) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL24795619 | 0.98 | SMN1; SMN2 (0.70) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1101299 | 0.97 | SMN1; SMN2 (0.72) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL6357075 | 0.92 | SMN1; SMN2 (0.74) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL30131390 | 0.86 | KMT2A (0.69) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL3715361 | 0.86 | KMT2A (0.69) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0998283-A1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-05-10 | — | — | EP | disclosed |
| WO-1998044925-A1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-10-15 | — | — | WO | disclosed |