Bromide

Bromide

SCHEMBL4909882

Br.C[C@H](N)c1ccc(O)cc1

nearest known ligand 0.59

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
ADRB2 known ✓ P07550 1/20 0.54
SLC6A2 known ✓ P23975 2/20 0.48
CHRM2 known ✓ P08172 1/20 0.46
ADRA1A known ✓ P35348 1/20 0.46
SLC6A3 known ✓ Q01959 1/20 0.46
HTR3A known ✓ P46098 1/20 0.44
ESR1 P03372 6/20 0.59
ESR2 Q92731 5/20 0.59
PDCD1 Q15116 1/20 0.59
CD274 Q9NZQ7 1/20 0.59
TAAR1 Q96RJ0 5/20 0.52
ALOX15 P16050 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
LMNA P02545 2/20 0.46
CYP3A4 P08684 2/20 0.46
MAPT P10636 2/20 0.46
CYP1A2 P05177 1/20 0.46
PGR P06401 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
AR P10275 1/20 0.46

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 SCHEMBL23672238 1.00 ESR1 (0.59) ESR1ESR2PDCD1CD274ADRB2
Bromide SCHEMBL15901678 1.00 ESR1 (0.59) ESR1ESR2PDCD1CD274ADRB2
SCHEMBL633374 0.97 ESR1 (0.62) ESR1ESR2PDCD1CD274ADRB2
SCHEMBL2032476 0.97 ESR1 (0.62) ESR1ESR2PDCD1CD274ADRB2
SCHEMBL2037513 0.97 ESR1 (0.62) ESR1ESR2PDCD1CD274ADRB2
Hydrochloric Acid SCHEMBL14830851 0.95 ESR1 (0.59) ESR1ESR2PDCD1CD274ADRB2
Hydrochloric Acid SCHEMBL8702706 0.95 ESR1 (0.59) ESR1ESR2PDCD1CD274ADRB2
Hydrochloric Acid SCHEMBL3178913 0.95 ESR1 (0.59) ESR1ESR2PDCD1CD274ADRB2
Iodide SCHEMBL29068279 0.95 ESR1 (0.59) ESR1ESR2PDCD1CD274ADRB2
SCHEMBL18664397 0.90 ESR1 (0.54) ESR1ESR2PDCD1CD274ADRB2

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
US-20080009534-A1 SUBSTITUTED ACID DERIVATIVES USEFUL AS ANTIDIABETIC AND ANTIOBESITY AGENTS AND METHOD BRISTOL-MYERS SQUIBB COMPANY 2008-01-10 US 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-20080009534-A1 SUBSTITUTED ACID DERIVATIVES USEFUL AS ANTIDIABETIC AND ANTIOBESITY AGENTS AND METHOD GPR119, LIPC, CEL ADRB2 877/4885SLC6A2 2081/4885CHRM2 1494/4885

“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.