Bromide

Bromide

SCHEMBL28217028

Br.C=C(C)C(=O)OCCCCCC

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

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 16)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 5/20 0.44
TSHR P16473 3/20 0.96
THRB P10828 1/20 0.55
NAAA Q02083 1/20 0.53
POLB P06746 1/20 0.51
APEX1 P27695 1/20 0.51
HTT P42858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
EPHX1 P07099 1/20 0.50
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 2/20 0.48
CES2 O00748 1/20 0.47
HCAR2 Q8TDS4 1/20 0.46
FAAH O00519 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL10586702 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL1977194 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL33994 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL21853811 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL21853806 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL6655183 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL11775454 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL15200 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL14995 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL22579031 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109004269-A Preparation method of self-assembled polyimidazole type all-solid-state polymer electrolyte containing 2D channel 南昌航空大学 2018-12-14 CN claimed
CN-109004269-A Preparation method of self-assembled polyimidazole type all-solid-state polymer electrolyte containing 2D channel 南昌航空大学 2018-12-14 CN disclosed
CN-107946641-A Ion liquid crystal/polyimidazole semi-interpenetrating network polymer electrolyte preparation method 南昌航空大学 2018-04-20 CN disclosed