Bromide

Bromide

SCHEMBL2835014

CCC(c1ccccc1)[n+]1ccn(C)c1.[Br-]

nearest known ligand 0.38

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 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR2A P28223 2/20 0.32
HRH1 P35367 1/20 0.32
TSHR P16473 1/20 0.32
POLB P06746 1/20 0.32
CYP19A1 P11511 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31

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 SCHEMBL22265217 0.98 LMNA (0.35) LMNAMEN1KMT2AHTR2AHRH1
SCHEMBL1503494 0.98 LMNA (0.37) LMNAMEN1KMT2AHTR2AHRH1
Hydrochloric Acid SCHEMBL1880314 0.97 LMNA (0.36) LMNAMEN1KMT2AHTR2AHRH1
SCHEMBL2832101 0.92 LMNA (0.34) LMNAMEN1KMT2AHTR2AHRH1
SCHEMBL5297040 0.90 LMNA (0.32) LMNA
SCHEMBL5303167 0.87 LMNA (0.30) LMNAPOLB
SCHEMBL5302234 0.87 HPGD (0.32) LMNATSHRPOLB
Trifluoromethanesulfonic Acid SCHEMBL2830948 0.84 KCNH2 (0.34) KMT2A
Bromide SCHEMBL22265218 0.82 HKDC1 (0.33)
Bromide SCHEMBL9661595 0.81 CYP17A1 (0.39) TSHRPOLBCYP19A1TDP1

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-20100048327-A1 Highly-Neutralized Golf Ball Compositions ACUSHNET COMPANY 2010-02-25 US disclosed