Bromide

Bromide

SCHEMBL531215

Br.NCCN1C=CN(Cc2ccccc2)C1

nearest known ligand 0.42

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
SIGMAR1 known ✓ Q99720 6/20 0.42
PRMT3 O60678 1/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
PRMT1 Q99873 1/20 0.40
PRMT8 Q9NR22 1/20 0.40
F2 P00734 1/20 0.39
PLG P00747 1/20 0.39
ELANE P08246 1/20 0.39
CTSG P08311 1/20 0.39
CMA1 P23946 1/20 0.39
CTRC Q99895 1/20 0.39
MC4R P32245 1/20 0.39
LOXL2 Q9Y4K0 2/20 0.39
CYP2A6 P11509 1/20 0.39
HTR2A P28223 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
FUCA1 P04066 2/20 0.37
KDM4E B2RXH2 1/20 0.36

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 SCHEMBL530874 0.89 SIGMAR1 (0.47) SIGMAR1F2PLGELANECTSG
Bromide SCHEMBL1046639 0.88 SIGMAR1 (0.50) SIGMAR1F2PLGELANECTSG
Bromide SCHEMBL532137 0.88 SIGMAR1 (0.46) SIGMAR1F2PLGELANECTSG
Bromide SCHEMBL530794 0.88 SIGMAR1 (0.49) SIGMAR1F2PLGELANECTSG
SCHEMBL1044027 0.86 SIGMAR1 (0.52) SIGMAR1F2PLGELANECTSG
Hydrochloric Acid SCHEMBL9343069 0.84 SIGMAR1 (0.50) SIGMAR1F2PLGELANECTSG
SCHEMBL5295885 0.81 MEN1 (0.44) SIGMAR1F2PLGELANECTSG
Bromide SCHEMBL1178793 0.81 CYP11B1 (0.41) SIGMAR1F2PLGELANECTSG
Bromide SCHEMBL31115579 0.81 SIGMAR1 (0.37) SIGMAR1F2PLGELANECTSG
Bromide SCHEMBL1179198 0.79 MC4R (0.44) SIGMAR1F2PLGELANECTSG

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
EP-2415741-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND Sumitomo Chemical Company, Limited (JP) 2012-02-08 EP disclosed
US-20120010417-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-12 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-20120010417-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND ADH1A, ADH1C, ADH5 SIGMAR1 1959/4885PRMT3 581/4885CARM1 98/4885

“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.