Bromide

Bromide

SCHEMBL15414765

Br.CC(C)(C)c1ccnc(Br)c1

nearest known ligand 0.40

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
HTR1D known ✓ P28221 2/20 0.33
ADRA1A known ✓ P35348 2/20 0.33
ADRA2A known ✓ P08913 1/20 0.33
ADRA2B known ✓ P18089 1/20 0.33
ADRA2C known ✓ P18825 1/20 0.33
ADRA1D known ✓ P25100 1/20 0.33
HTR1B known ✓ P28222 1/20 0.33
ADRA1B known ✓ P35368 1/20 0.33
AR P10275 4/20 0.40
KIF11 P52732 2/20 0.37
ALDH1A1 P00352 3/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
IDO1 P14902 1/20 0.34
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL29839612 0.98 AR (0.41) ARKIF11ALDH1A1HPGDALOX15
SCHEMBL295096 0.98 AR (0.41) ARKIF11ALDH1A1HPGDALOX15
SCHEMBL20994195 0.87 AR (0.41) ARKIF11ALDH1A1MEN1MAPT
SCHEMBL568588 0.81 NOS3 (0.39) ARIDO1MEN1KMT2ANOS3
SCHEMBL218725 0.81 AR (0.45) ARIDO1MEN1KMT2ANOS3
SCHEMBL14636523 0.81 NOS3 (0.39) ARIDO1NOS3NOS2HDAC8
SCHEMBL30847943 0.81 AR (0.45) ARIDO1MEN1KMT2ANOS3
SCHEMBL22140291 0.79 AR (0.41) ARALDH1A1HPGDTDP1IDO1
Hydrochloric Acid SCHEMBL19029428 0.79 NOS3 (0.38) ARIDO1NOS3NOS2
SCHEMBL27145090 0.78 AR (0.37) ARHSD17B10IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150171351-A1 LIGHT-EMITTING COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2015-06-18 US disclosed
WO-2014009716-A1 LIGHT-EMITTING COMPOUND CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2014-01-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150171351-A1 LIGHT-EMITTING COMPOUND NR2E3, MC1R, GALR1 HTR1D 137/4885ADRA1A 80/4885ADRA2A 86/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.