Iodide

Iodide

SCHEMBL7549720

COc1ccc(CCC[Zn+])cc1.[I-]

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

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)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 2/20 0.60
TAAR1 Q96RJ0 1/20 0.55
AOC3 Q16853 2/20 0.53
IGF1R P08069 1/20 0.53
ALOX15 P16050 1/20 0.53
TUBB4A P04350 1/20 0.52
TUBB P07437 1/20 0.52
TUBA3C P0DPH7 1/20 0.52
TUBA1B P68363 1/20 0.52
TUBA4A P68366 1/20 0.52
TUBB4B P68371 1/20 0.52
TUBB3 Q13509 1/20 0.52
TUBB2A Q13885 1/20 0.52
TUBB8 Q3ZCM7 1/20 0.52
TUBA3E Q6PEY2 1/20 0.52
TUBA1A Q71U36 1/20 0.52
TUBA1C Q9BQE3 1/20 0.52
TUBB6 Q9BUF5 1/20 0.52
TUBB2B Q9BVA1 1/20 0.52
TUBB1 Q9H4B7 1/20 0.52

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.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL29127872 0.96 CALM1 (0.60) CALM1TAAR1AOC3IGF1RALOX15
Iodide SCHEMBL7544118 0.87 TAAR1 (0.59) CALM1TAAR1AOC3TUBB4ATUBB
SCHEMBL244070 0.84 CALM1 (0.79) CALM1TAAR1AOC3IGF1RALOX15
SCHEMBL4254058 0.84 CALM1 (0.72) CALM1TAAR1AOC3IGF1RALOX15
SCHEMBL10571532 0.82 CALM1 (0.69) CALM1TAAR1AOC3IGF1RALOX15
SCHEMBL17400406 0.82 CALM1 (0.69) CALM1TAAR1AOC3IGF1RALOX15
SCHEMBL11007798 0.82 CALM1 (0.69) CALM1TAAR1AOC3IGF1RALOX15
SCHEMBL9509173 0.82 CALM1 (0.69) CALM1TAAR1AOC3IGF1RALOX15
SCHEMBL834551 0.79 TAAR1 (0.73) CALM1TAAR1AOC3TUBB4ATUBB
SCHEMBL31344104 0.79 CALM1 (0.60) CALM1TAAR1AOC3IGF1RALOX15

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6482990-B1 Prostaglandin E analogues TAISHO PHARMACEUTICAL CO., LTD. (JP) 2002-11-19 US disclosed
EP-1211241-A1 PROSTAGLANDIN E ANALOGUES TAISHO PHARMACEUTICAL CO., LTD (JP) 2002-06-05 EP disclosed