Bromide

Bromide

SCHEMBL17766599

Br.CCCCCCCCN1C=CN(c2cccc3ccccc23)C1

nearest known ligand 0.48

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
SLC6A3 known ✓ Q01959 1/20 0.36
DPP4 P27487 1/20 0.41
ALDH1A1 P00352 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
CNR1 P21554 5/20 0.38
CNR2 P34972 5/20 0.38
TLR8 Q9NR97 2/20 0.38
KDM4E B2RXH2 3/20 0.37
LMNA P02545 2/20 0.37
ELANE P08246 1/20 0.36
NPC1 O15118 2/20 0.36
GAA P10253 2/20 0.36
HTT P42858 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HPGD P15428 1/20 0.36
MEN1 O00255 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 SCHEMBL17766639 1.00 DPP4 (0.41) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
Bromide SCHEMBL29526881 1.00 DPP4 (0.41) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
Bromide SCHEMBL29526851 1.00 DPP4 (0.41) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL29527198 0.99 DPP4 (0.42) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL16098079 0.99 DPP4 (0.42) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL29526691 0.99 DPP4 (0.42) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL16098365 0.99 DPP4 (0.42) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
Iodide SCHEMBL29527142 0.97 DPP4 (0.41) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
Iodide SCHEMBL29526714 0.97 DPP4 (0.41) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19
Iodide SCHEMBL17766600 0.97 DPP4 (0.41) DPP4ALDH1A1CYP1A2CYP2D6CYP2C19

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-10266498-B2 Family of discriminating molecules for neutron and gamma rays and ionic liquids CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2019-04-23 US disclosed
US-20160145214-A1 New Family of Discriminating Molecules for Neutron and Gamma Rays and Ionic Liquids CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2016-05-26 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 (2 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-20160145214-A1 New Family of Discriminating Molecules for Neutron and Gamma Rays and Ionic Liquids XRCC5, XRCC6, KPNA3 SLC6A3 4066/4885DPP4 4608/4885ALDH1A1 4780/4885
US-10266498-B2 Family of discriminating molecules for neutron and gamma rays and ionic liquids KPNA3, KPNA4, XRCC5 SLC6A3 3779/4885DPP4 4650/4885ALDH1A1 4760/4885

“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.