Bromide

Bromide

SCHEMBL6849872

Br.CC(C)(C)c1ccc(OC(=O)Nc2ccccc2)cc1

nearest known ligand 0.67

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
ACHE known ✓ P22303 1/20 0.50
ALDH1A1 P00352 5/20 0.67
GAA P10253 2/20 0.67
HTT P42858 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
RAB9A P51151 2/20 0.61
MAPT P10636 4/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
KDM4E B2RXH2 2/20 0.61
POLB P06746 1/20 0.61
CYP2D6 P10635 1/20 0.61
ATM Q13315 1/20 0.61
HSD17B10 Q99714 1/20 0.61
TDP1 Q9NUW8 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
LMNA P02545 1/20 0.56
TP53 P04637 1/20 0.56
FAAH O00519 2/20 0.55
THRB P10828 1/20 0.54

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
SCHEMBL9126978 0.98 ALDH1A1 (0.69) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9126998 0.92 ALDH1A1 (0.69) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9187129 0.88 ALDH1A1 (0.67) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9126567 0.84 ALDH1A1 (0.61) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL1834517 0.84 RAB9A (0.65) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9126667 0.82 ALDH1A1 (0.60) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL1012812 0.82 CYP1A2 (0.65) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL27836777 0.82 KMT2A (0.62) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL23240070 0.81 ALDH1A1 (0.67) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9187138 0.81 ALDH1A1 (0.67) ALDH1A1GAAHTTSMN1; SMN2RAB9A

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
EP-1394152-A1 2-IMINOIMIDAZOLE DERIVATIVES (1) Eisai Co., Ltd. (JP) 2004-03-03 EP disclosed