Bromide

Bromide

SCHEMBL28248448

C=CC(=O)OCC[N+](C)(C)C(C)CCCCCCCCCCC.[Br-]

nearest known ligand 0.51

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 18)

geneUniProtsupporting neighboursconfidence
▸ ACHE known ✓ P22303 2/20 0.36
▸ TSHR P16473 8/20 0.51
▸ HPGD P15428 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ HCAR2 Q8TDS4 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ TP53 P04637 2/20 0.37
▸ HIF1A Q16665 2/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ ABCB1 P08183 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ ZDHHC20 Q5W0Z9 1/20 0.36
▸ ZDHHC2 Q9UIJ5 1/20 0.36
▸ THRB P10828 1/20 0.35
▸ ZDHHC7 Q9NXF8 1/20 0.35
▸ RAD52 P43351 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34

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
Bromide SCHEMBL28187197 1.00 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4HCAR2
Bromide SCHEMBL28109247 0.89 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL28057251 0.85 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4HCAR2
Hydrochloric Acid SCHEMBL28912715 0.80 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4MAPT
Bromide SCHEMBL27719168 0.80 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4HCAR2
Bromide SCHEMBL28635420 0.79 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HCAR2
Bromide SCHEMBL8196037 0.79 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HCAR2
Bromide SCHEMBL29140475 0.79 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HCAR2
Bromide SCHEMBL29140477 0.79 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HCAR2
Bromide SCHEMBL28633922 0.79 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108546315-B Amphiphilic polymer oil displacement agent and preparation method and application thereof 中国海洋石油集团有限公司 2020-05-12 — — CN claimed
CN-108715757-A A kind of preparation method of acidproof thickening agent and its application in multifunctional acid and acid-resistant pressing crack liquid 成都劳恩普斯科技有限公司 2018-10-30 — — CN claimed
CN-108530645-B Amphiphilic dendritic unsaturated monomer and preparation method and application thereof 中国海洋石油集团有限公司 2021-02-19 — — CN disclosed
CN-108546315-B Amphiphilic polymer oil displacement agent and preparation method and application thereof 中国海洋石油集团有限公司 2020-05-12 — — CN disclosed
CN-108546315-B Amphiphilic polymer oil displacement agent and preparation method and application thereof 中国海洋石油集团有限公司 2020-05-12 — — CN disclosed
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