Iodide

Iodide

SCHEMBL29022372

I.Nc1cccc2[nH]ccc12

nearest known ligand 0.54

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
AHR P35869 2/20 0.54
TDP1 Q9NUW8 2/20 0.53
PARP1 P09874 1/20 0.53
RECQL P46063 1/20 0.53
ALDH1A1 P00352 2/20 0.46
CYP3A4 P08684 2/20 0.46
HPGD P15428 2/20 0.46
TSHR P16473 2/20 0.46
HSD17B10 Q99714 2/20 0.46
RHEB Q15382 7/20 0.46
MAPK1 P28482 1/20 0.46
PIK3CD O00329 1/20 0.44
GFER P55789 1/20 0.43
HTR6 P50406 2/20 0.42
ADRB1 P08588 1/20 0.42
ASH1L Q9NR48 1/20 0.41
TRPA1 O75762 2/20 0.39
KEAP1 Q14145 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL113992 0.98 AHR (0.56) AHRTDP1PARP1RECQLALDH1A1
SCHEMBL29670267 0.98 AHR (0.56) AHRTDP1PARP1RECQLALDH1A1
Hydrochloric Acid SCHEMBL6945346 0.95 AHR (0.54) AHRTDP1PARP1RECQLALDH1A1
Ammonia Solution, Strong SCHEMBL9935854 0.95 AHR (0.54) AHRTDP1PARP1RECQLALDH1A1
Methylene Chloride SCHEMBL27828016 0.90 TDP1 (0.48) AHRTDP1PARP1RECQLALDH1A1
SCHEMBL27579654 0.79 HTR1A (0.41) AHRTDP1PARP1RECQLALDH1A1
Tert-Butyl Formate SCHEMBL28030918 0.78 TDP1 (0.42) AHRTDP1PARP1RECQLRHEB
Ethoxycarbonyl Group SCHEMBL27965810 0.77 PARP1 (0.41) AHRTDP1PARP1RECQLRHEB
Quinoline SCHEMBL27756079 0.77 ALDH1A1 (0.50) AHRTDP1PARP1RECQLALDH1A1
SCHEMBL28126424 0.77 PARP1 (0.41) AHRTDP1PARP1RECQLALDH1A1

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
CN-115942757-A A-site doped halide perovskite type solar cell and preparation method thereof 暨南大学 2023-04-07 CN claimed
CN-115942757-A A-site doped halide perovskite type solar cell and preparation method thereof 暨南大学 2023-04-07 CN disclosed