Iodide

Iodide

SCHEMBL7197935

Cc1ccc(C[P+](c2ccc(C)cc2)(c2ccc(C)cc2)c2ccc(C)cc2)cc1.[I-]

nearest known ligand 0.44

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 17)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.38
SNCA P37840 2/20 0.44
IDO1 P14902 2/20 0.42
CYP1A2 P05177 1/20 0.39
CYP2A6 P11509 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
AGXT P21549 2/20 0.38
CHRM2 P08172 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
HPGD P15428 1/20 0.32

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 SCHEMBL7195007 0.95 SNCA (0.44) SNCAIDO1CYP1A2CYP2A6TAAR1
Bromide SCHEMBL7197676 0.95 SNCA (0.47) SNCAIDO1CYP1A2CYP2A6TAAR1
Iodide SCHEMBL6060565 0.89 SNCA (0.48) SNCACYP1A2CYP2A6TAAR1ACHE
Iodide SCHEMBL7198869 0.87 ACHE (0.54) IDO1CYP1A2ACHETDP1ALDH1A1
Bromide SCHEMBL7195807 0.86 ALDH1A1 (0.50) SNCAIDO1CYP1A2TAAR1MEN1
Phosphoric Acid SCHEMBL7196602 0.86 FDFT1 (0.41) SNCAIDO1CYP1A2CYP2A6TAAR1
Hydrochloric Acid SCHEMBL6060972 0.85 SNCA (0.48) SNCACYP1A2CYP2A6TAAR1ACHE
Bromide SCHEMBL6060661 0.85 SNCA (0.52) SNCACYP1A2CYP2A6TAAR1ACHE
Hydrochloric Acid SCHEMBL2452316 0.85 SNCA (0.58) SNCAIDO1ACHETDP1MEN1
Bromide SCHEMBL2447513 0.85 SNCA (0.61) SNCAIDO1ACHETDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0624173-B2 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS DOW CHEMICAL CO (US) 2003-04-09 EP disclosed
EP-0624173-A1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS. DOW CHEMICAL CO (US) 1994-11-17 EP disclosed
US-5360886-A Alklyphenylphosphine or phosphonium catalyst THE DOW CHEMICAL COMPANY (US) 1994-11-01 US disclosed
US-5310853-A Epoxy resins THE DOW CHEMICAL COMPANY (US) 1994-05-10 US disclosed
WO-1993015126-A1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS THE DOW CHEMICAL COMPANY (US) 1993-08-05 WO disclosed
US-5202407-A Phosphonium or phosphine catalyst having at least three alkylphenyl groups attached to phosphorus atom THE DOW CHEMICAL COMPANY (US) 1993-04-13 US disclosed