Bromide

Bromide

SCHEMBL2532767

Br.O=C(CN1C=CN(CC(=O)c2ccc(Cl)cc2)C1)c1ccc(Cl)cc1

nearest known ligand 0.51

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
RAB9A P51151 3/20 0.51
GSK3B P49841 2/20 0.50
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
MAPT P10636 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MITF O75030 1/20 0.44
S1PR4 O95977 1/20 0.44
TP53 P04637 1/20 0.44
S1PR1 P21453 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 1/20 0.43
MGAM O43451 1/20 0.43
AMY1A P0DUB6 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
KMT2A Q03164 3/20 0.43

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
SCHEMBL12220178 0.98 GSK3B (0.52) RAB9AGSK3BERCC5FEN1MAPT
SCHEMBL11244190 0.87 CXCR3 (0.45) RAB9AGSK3BMAPTALDH1A1MITF
SCHEMBL28841342 0.83 MEN1 (0.45) RAB9AGSK3BMAPTALDH1A1MITF
Bromide SCHEMBL6073932 0.82 KMT2A (0.54) RAB9AGSK3BMAPTALDH1A1TP53
Bromide SCHEMBL6074363 0.81 ALDH1A1 (0.49) RAB9AGSK3BMAPTALDH1A1SMN1; SMN2
SCHEMBL28841458 0.81 GSK3B (0.42) RAB9AGSK3BMAPTALDH1A1HTT
SCHEMBL17966245 0.79 ALDH1A1 (0.53) RAB9AALDH1A1NPC1MGAMAMY1A
Bromide SCHEMBL6074980 0.79 SMN1; SMN2 (0.58) RAB9AGSK3BERCC5FEN1MAPT
Bromide SCHEMBL4114709 0.79 RAB9A (0.46) RAB9AGSK3BERCC5FEN1MAPT
Bromide SCHEMBL6843500 0.78 CXCR3 (0.49) RAB9AMAPTALDH1A1HTTNPC1

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-8632914-B2 Triazolium and imidazolium salts and uses thereof UNIVERSITY HEALTH NETWORK (CA) 2014-01-21 US disclosed
US-20110257235-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF UNIVERSITY HEALTH NETWORK (CA) 2011-10-20 US disclosed
WO-2010025558-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF AS ANTIMALARIALS UNIVERSITY HAEALTH NETWORK (CA) 2010-03-11 WO disclosed
US-7022721-B1 Method and composition for rejuvenating cells, tissues, organs, hair and nails ULRICH PETER C 2006-04-04 US disclosed
US-20050245512-A1 Method and composition for rejuvinating cells, tissues organs, hair and nails ULRICH PETER C 2005-11-03 US disclosed
US-6777557-B2 Method and composition for rejuvenating cells, tissues organs, hair and nails FARRINGTON PHARMACEUTICALS, LLC 2004-08-17 US disclosed
US-20020188015-A1 Method and composition for rejuvinating cells, tissues organs, hair and nails FARRINGTON PHARMACEUTICALS, LLC 2002-12-12 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 (3 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-20020188015-A1 Method and composition for rejuvinating cells, tissues organs, hair and nails TERT, TELO2, HKDC1 RAB9A 1317/4885GSK3B 2693/4885ERCC5 778/4885
US-20110257235-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF ARG2, ARG1, CIT RAB9A 1643/4885GSK3B 3036/4885ERCC5 4060/4885
US-20050245512-A1 Method and composition for rejuvinating cells, tissues organs, hair and nails TERT, TELO2, HKDC1 RAB9A 1317/4885GSK3B 2693/4885ERCC5 778/4885

“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.