Bromide

Bromide

SCHEMBL3660816

Br.O=C(O)c1ccccc1P(c1ccccc1)c1ccccc1

nearest known ligand 0.52

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
ALDH1A1 P00352 6/20 0.52
ALOX15 P16050 1/20 0.52
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA4 P22748 3/20 0.45
CA7 P43166 3/20 0.45
CA9 Q16790 3/20 0.45
KDM4E B2RXH2 2/20 0.45
HMGB1 P09429 2/20 0.45
HPGD P15428 2/20 0.45
NAPRT Q6XQN6 2/20 0.45
CA6 P23280 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CA14 Q9ULX7 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 2/20 0.43
HDAC8 Q9BY41 1/20 0.43
POLB P06746 1/20 0.42

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
SCHEMBL29404318 0.98 ALDH1A1 (0.54) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL989596 0.98 ALDH1A1 (0.54) ALDH1A1ALOX15CA12CA1CA2
Phosphine SCHEMBL22446073 0.96 ALDH1A1 (0.52) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL5597248 0.96 ALDH1A1 (0.52) ALDH1A1ALOX15CA12CA1CA2
Ammonia Solution, Strong SCHEMBL31339444 0.96 ALDH1A1 (0.52) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL31553567 0.96 ALDH1A1 (0.52) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL7564286 0.94 ALDH1A1 (0.54) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL31003867 0.90 ALDH1A1 (0.46) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL7260802 0.87 ALDH1A1 (0.62) ALDH1A1ALOX15CA12CA1CA2
SCHEMBL1524729 0.85 CYP3A4 (0.46) ALDH1A1ALOX15CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2048731-B1 Resin composition for fuel cell separator and fuel cell separator manufactured therefrom NICHIAS CORP (JP) 2010-08-25 EP disclosed
US-20090098447-A1 RESIN COMPOSITION FOR FUEL CELL SEPARATOR, AND FUEL CELL SEPARATOR NICHIAS CORPORATION (JP) 2009-04-16 US disclosed
EP-2048731-A1 Resin composition for fuel cell separator and fuel cell separator manufactured therefrom Nichias Corporation (JP) 2009-04-15 EP disclosed
EP-1890352-A1 Fuel cell separator composition, fuel cell separator, and method for producing the same NICHIAS CORPORATION (JP) 2008-02-20 EP disclosed
US-20080032176-A1 Fuel cell separator composition, fuel cell separator, and method for producing the same NICHIAS CORPORATION (JP) 2008-02-07 US disclosed
US-20060204819-A1 Conductive epoxy resin composition and separator for fuel cell NICHIAS CORPORATION (JP) 2006-09-14 US disclosed
EP-1701400-A1 Conductive epoxy resin composition and separator for fuel cell NICHIAS CORPORATION (JP) 2006-09-13 EP disclosed