Bromide

Bromide

SCHEMBL10932746

CCCCCCCCCCCCCCCCC(COP(=O)(O)OCC[N+](C)(C)C)OC.[Br-]

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

The experimentally established mechanism targets of Bromide. 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
▸ FABP3 P05413 1/20 0.60
▸ PRKD3 O94806 2/20 0.57
▸ PRKCG P05129 2/20 0.57
▸ PRKCB P05771 2/20 0.57
▸ PRKCA P17252 2/20 0.57
▸ PRKCH P24723 2/20 0.57
▸ PRKCI P41743 2/20 0.57
▸ PRKCE Q02156 2/20 0.57
▸ PRKCQ Q04759 2/20 0.57
▸ PRKCZ Q05513 2/20 0.57
▸ PRKCD Q05655 2/20 0.57
▸ PRKD1 Q15139 2/20 0.57
▸ AKT1 P31749 2/20 0.57
▸ LMNA P02545 2/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ GMNN O75496 1/20 0.57
▸ BLM P54132 1/20 0.57

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
SCHEMBL26641823 0.90 PRKD3 (0.53) FABP3PRKD3PRKCGPRKCBPRKCA
SCHEMBL11124843 0.89 FABP3 (0.54) FABP3PRKD3PRKCGPRKCBPRKCA
Edelfosine SCHEMBL1962471 0.88 AKT1 (0.73) FABP3PRKD3PRKCGPRKCBPRKCA
Edelfosine SCHEMBL4177817 0.88 AKT1 (0.73) FABP3PRKD3PRKCGPRKCBPRKCA
SCHEMBL29464127 0.88 AKT1 (0.73) FABP3PRKD3PRKCGPRKCBPRKCA
SCHEMBL23016734 0.88 AKT1 (0.73) FABP3PRKD3PRKCGPRKCBPRKCA
Edelfosine SCHEMBL8251942 0.88 AKT1 (0.73) FABP3PRKD3PRKCGPRKCBPRKCA
SCHEMBL14447847 0.88 AKT1 (0.73) FABP3PRKD3PRKCGPRKCBPRKCA
SCHEMBL8257173 0.88 AKT1 (0.73) FABP3PRKD3PRKCGPRKCBPRKCA
SCHEMBL12380305 0.88 AKT1 (0.73) FABP3PRKD3PRKCGPRKCBPRKCA

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
US-4562179-A ANTITUMOR AND ANTICARCINOGENIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-12-31 — — US disclosed
Send feedback