Iodide

Iodide

SCHEMBL29162131

CC(C)(C)c1cccc(-c2ccccc2)c1C(C)(C)C.I

nearest known ligand 0.40

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
CA2 P00918 1/20 0.40
ALDH1A1 P00352 4/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PTPN5 P54829 1/20 0.37
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
HSD17B10 Q99714 2/20 0.35
CYP2A6 P11509 2/20 0.35
HPGD P15428 1/20 0.35
BCL2L1 Q07817 1/20 0.35
MAPK1 P28482 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
CYP2B6 P20813 1/20 0.35
KIF11 P52732 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TRPA1 O75762 1/20 0.34
PTGS2 P35354 1/20 0.33
HSD11B1 P28845 1/20 0.33

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
SCHEMBL1194487 0.98 CA2 (0.41) CA2ALDH1A1TSHRTDP1PTPN5
SCHEMBL27480276 0.98 CA2 (0.41) CA2ALDH1A1TSHRTDP1PTPN5
Phosphine SCHEMBL2238719 0.96 CA2 (0.40) CA2ALDH1A1TSHRTDP1PTPN5
SCHEMBL545685 0.96 CA2 (0.40) CA2ALDH1A1TSHRTDP1PTPN5
SCHEMBL27587488 0.96 CA2 (0.40) CA2ALDH1A1TSHRTDP1PTPN5
Bicarbonate SCHEMBL27636739 0.91 CA2 (0.41) CA2ALDH1A1TSHRTDP1PTPN5
SCHEMBL27759190 0.90 CA2 (0.39) CA2ALDH1A1TSHRTDP1PTPN5
SCHEMBL26004347 0.85 ALDH1A1 (0.42) ALDH1A1TDP1PDCD1CD274HSD17B10
SCHEMBL31067657 0.84 ALDH1A1 (0.38) CA2ALDH1A1TSHRTDP1PTPN5
SCHEMBL4461655 0.83 CA2 (0.50) CA2ALDH1A1TSHRTDP1PTPN5

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117631439-A Photoresist film and application thereof 长春人造树脂厂股份有限公司 2024-03-01 CN disclosed