Bromide

Bromide

SCHEMBL8848768

COC(=O)C[n+]1ccc(C=Cc2ccc(C=O)cc2)cc1.[Br-]

nearest known ligand 0.47

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 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
PTGS2 P35354 2/20 0.41
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 2/20 0.37
GSK3B P49841 1/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
CRHBP P24387 1/20 0.37
APOBEC3A P31941 1/20 0.37
CRHR2 Q13324 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
CYP2A6 P11509 1/20 0.37

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 SCHEMBL8848766 1.00 ALDH1A1 (0.44) ALDH1A1PTGS2CYP4F2CYP4A11CYP1A2
Bromide SCHEMBL8848908 0.87 CA12 (0.41) ALDH1A1KMT2AMEN1
Bromide SCHEMBL8849383 0.87 ALDH1A1 (0.42) ALDH1A1PTGS2CYP4F2CYP4A11CYP1A2
Bromide SCHEMBL5279859 0.87 CA12 (0.41) ALDH1A1KMT2AMEN1
Bromide SCHEMBL5279218 0.84 KMT2A (0.44) ALDH1A1PTGS2CYP4F2CYP4A11CYP1A2
SCHEMBL1899174 0.78 KMT2A (0.38) ALDH1A1PTGS2KMT2AMEN1
SCHEMBL9591167 0.78 KMT2A (0.38) ALDH1A1PTGS2KMT2AMEN1
Hydrochloric Acid SCHEMBL11387894 0.76 KMT2A (0.37) ALDH1A1PTGS2KMT2AMEN1
Hydrochloric Acid SCHEMBL11387891 0.76 KMT2A (0.37) ALDH1A1PTGS2KMT2AMEN1
Bromide SCHEMBL5391070 0.74 KMT2A (0.43) ALDH1A1PTGS2CYP4F2CYP4A11CYP1A2

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
EP-0555070-B1 Photocurable compositions SERICOL LTD (GB) 1997-04-16 EP disclosed
US-5332651-A Screen printing SERICOL LIMITED (GB) 1994-07-26 US disclosed
EP-0555070-A1 Photocurable compositions SERICOL LIMITED (GB) 1993-08-11 EP disclosed