Bromide

Bromide

SCHEMBL3626512

Br.C=Cc1cccc(C(=O)O)c1

nearest known ligand 0.66

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 20)

geneUniProtsupporting neighboursconfidence
UNG P13051 1/20 0.66
TTR P02766 4/20 0.56
FBP1 P09467 1/20 0.53
P4HB P07237 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA6 P23280 1/20 0.50
CA9 Q16790 1/20 0.50
KMO O15229 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 2/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 2/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
ALDH1A1 P00352 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
SCHEMBL21777904 0.98 UNG (0.68) UNGTTRFBP1P4HBCA12
SCHEMBL15036 0.98 UNG (0.68) UNGTTRFBP1P4HBCA12
SCHEMBL29373775 0.98 UNG (0.68) UNGTTRFBP1P4HBCA12
Benzene SCHEMBL16487418 0.98 UNG (0.68) UNGTTRFBP1P4HBCA12
Hydrochloric Acid SCHEMBL2907557 0.96 UNG (0.66) UNGTTRFBP1P4HBCA12
Iodide SCHEMBL3625902 0.96 UNG (0.66) UNGTTRFBP1P4HBCA12
Isophthalic Acid SCHEMBL28305860 0.88 UNG (0.60) UNGTTRFBP1CA12CA1
Terephthalic Acid SCHEMBL6270577 0.85 UNG (0.56) UNGTTRFBP1CA12CA1
SCHEMBL28242748 0.83 TDP1 (0.52) UNGTTRFBP1TDP1TP53
SCHEMBL1941954 0.82 ATM (0.63) UNGHPGDHSD17B10TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795347-B2 Multi-branched polymer, process for producing the same, and applications thereof MITSUI CHEMICALS, INC. (JP) 2010-09-14 US disclosed
EP-1396504-B1 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof MITSUI CHEMICALS INC (JP) 2009-01-14 EP disclosed
EP-1457512-B1 Multi-branched polymer, process for producing the same, and applications thereof MITSUI CHEMICALS INC (JP) 2008-05-07 EP disclosed
US-7067587-B2 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof MITSUI CHEMICALS, INC. (JP) 2006-06-27 US disclosed
US-20040242791-A1 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof MITSUI CHEMICALS, INC. (JP) 2004-12-02 US disclosed
US-20040220346-A1 Multi-branched polymer, process for producing the same, and applications thereof MITSUI CHEMICALS, INC. (JP) 2004-11-04 US disclosed
EP-1457512-A1 Multi-branched polymer, process for producing the same, and applications thereof Mitsui Chemicals, Inc. (JP) 2004-09-15 EP disclosed
EP-1396504-A2 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof Mitsui Chemicals, Inc. (JP) 2004-03-10 EP disclosed