Bromide

Bromide

SCHEMBL1983500

Br.O=[N+]([O-])c1ccc(-c2cn3cccnc3n2)cc1

nearest known ligand 0.62

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 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.62
KDM4E B2RXH2 11/20 0.62
HPGD P15428 6/20 0.62
GLA P06280 5/20 0.62
HSD17B10 Q99714 4/20 0.62
RAB9A P51151 12/20 0.62
NPC1 O15118 10/20 0.62
GAA P10253 7/20 0.62
SMN1; SMN2 Q16637 5/20 0.62
KMT2A Q03164 4/20 0.62
MAPT P10636 4/20 0.62
MEN1 O00255 3/20 0.62
TP53 P04637 3/20 0.62
POLB P06746 2/20 0.58
CYP1A2 P05177 2/20 0.55
GFER P55789 1/20 0.51
RXFP1 Q9HBX9 1/20 0.50
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL12422226 0.99 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL15558568 0.84 CASP3 (0.65) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL5305847 0.78 ALDH1A1 (0.76) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL10753831 0.78 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL3671367 0.78 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDGLAHSD17B10
Bromide SCHEMBL30277628 0.78 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL1692157 0.77 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL12970202 0.77 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL9298339 0.77 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL17626882 0.77 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDGLAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11582970-B2 2-aminoimidazole-phenyl derivatives useful for controlling microbial growth NORTH CAROLINA STATE UNIVERSITY (US) 2023-02-21 US disclosed
WO-2018169752-A1 2-AMINOIMIDAZOLE-PHENYL DERIVATIVES USEFUL FOR CONTROLLING MICROBIAL GROWTH NORTH CAROLINA STATE UNIVERSITY (US) 2018-09-20 WO disclosed
EP-2338059-B1 Ligands for aggregated tau molecules WISTA LAB LTD (SG) 2015-04-08 EP disclosed
US-8895313-B2 Ligands for aggregated tau molecules WISTA LABORATORIES LTD. (SG) 2014-11-25 US disclosed
US-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 US disclosed
EP-2338059-A1 LIGANDS FOR AGGREGATED TAU MOLECULES Wista Laboratories Ltd. (SG) 2011-06-29 EP disclosed
WO-2010034982-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. (SG) 2010-04-01 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 (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-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES MAPT, PRNP, MAP4 ALDH1A1 2058/4885KDM4E 4073/4885HPGD 2508/4885
US-11582970-B2 2-aminoimidazole-phenyl derivatives useful for controlling microbial growth DDC, IL4I1, ING2 ALDH1A1 1809/4885KDM4E 571/4885HPGD 879/4885

“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.