Bromide

Bromide

SCHEMBL1509660

Br.CC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C

nearest known ligand 0.49

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 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.49
DPP8 Q6V1X1 2/20 0.49
DPP9 Q86TI2 2/20 0.49
XIAP P98170 3/20 0.43
MLX Q9UH92 1/20 0.41
FAP Q12884 2/20 0.40
DPP7 Q9UHL4 2/20 0.40
PREP P48147 2/20 0.40
ELANE P08246 6/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL2768336 0.99 DPP4 (0.50) DPP4DPP8DPP9XIAPMLX
SCHEMBL30052033 0.88 ACE (0.51) DPP4DPP8DPP9XIAPMEN1
SCHEMBL14953540 0.86 DPP4 (0.46) DPP4DPP8DPP9XIAPMLX
SCHEMBL13380009 0.86 XIAP (0.47) DPP4DPP8DPP9XIAPMLX
Bromide SCHEMBL1509597 0.84 DPP4 (0.42) DPP4DPP8DPP9XIAPMLX
SCHEMBL29378104 0.84 ACE (0.47) DPP4DPP8DPP9XIAPMEN1
Bromide SCHEMBL3164359 0.84 XIAP (0.47) DPP4DPP8DPP9XIAPFAP
SCHEMBL17305252 0.83 DPP4 (0.52) DPP4DPP8DPP9ELANE
SCHEMBL13379994 0.83 XIAP (0.49) DPP4DPP8DPP9XIAPMLX
SCHEMBL13073333 0.82 DPP4 (0.49) DPP4DPP8DPP9XIAPMLX

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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1675578-B9 INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR THE TREATMENT OF THE NEURODEGENERATIVE DISEASES FBD AND FDD PROBIODRUG AG (DE) 2014-06-25 EP claimed
US-8470781-B2 Use of effectors of glutaminyl and glutamate cyclases PROBIODRUG AG (DE) 2013-06-25 US claimed
EP-1675578-B1 INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR THE TREATMENT OF THE NEURODEGENERATIVE DISEASES FBD AND FDD PROBIODRUG AG (DE) 2013-05-22 EP claimed
EP-2289498-A1 Use of inhibitors of glutaminyl clyclase Probiodrug AG (DE) 2011-03-02 EP claimed
EP-1620082-B9 MEDICAL USE OF INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR TREATING ALZHEIMER'S DISEASE AND DOWN SYNDROME PROBIODRUG AG (DE) 2010-08-25 EP claimed
EP-2206496-A1 Medical use of inhibitors of glutaminyl and glutamate cyclases Probiodrug AG (DE) 2010-07-14 EP claimed
EP-1620082-B1 MEDICAL USE OF INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR TREATING ALZHEIMER'S DISEASE AND DOWN SYNDROME PROBIODRUG AG (DE) 2010-04-21 EP claimed
US-7608577-B2 Peptidyl ketones as inhibitors of DPIV OSI PHARMACEUTICALS, INC. (US) 2009-10-27 US claimed
US-20090149394-A1 USE OF EFFECTORS OF GLUTAMINYL AND GLUTAMATE CYCLASES PROBIODRUG AG (DE) 2009-06-11 US claimed
US-7462599-B2 Use of effectors of glutaminyl and glutamate cyclases PROBIODRUG AG (DE) 2008-12-09 US claimed
EP-1961416-A1 Medical use of inhibitors of glutaminyl and glutamate cyclases Probiodrug AG (DE) 2008-08-27 EP claimed
US-7381537-B2 Use of inhibitors of glutaminyl cyclases for treatment and prevention of disease PROBIODRUG AG (DE) 2008-06-03 US claimed
US-20060189523-A1 Use of effectors of glutaminyl and glutamate cyclases PROBIODRUG AG (DE) 2006-08-24 US claimed
EP-1434792-A2 PEPTIDYL KETONES AS INHIBITORS OF DPIV Probiodrug AG (DE) 2004-07-07 EP claimed
US-20030148961-A1 Peptidyl ketones as inhibitors of DPIV PROSIDION LIMITED (GB) 2003-08-07 US claimed
WO-2003033524-A2 PEPTIDYL KETONES AS INHIBITORS OF DPIV PROBIODRUG AG (DE) 2003-04-24 WO claimed
EP-1675578-B9 INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR THE TREATMENT OF THE NEURODEGENERATIVE DISEASES FBD AND FDD PROBIODRUG AG (DE) 2014-06-25 EP disclosed
US-8470781-B2 Use of effectors of glutaminyl and glutamate cyclases PROBIODRUG AG (DE) 2013-06-25 US disclosed
US-20040224875-A1 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2004-11-11 US disclosed
WO-2004031374-A2 SECONDARY BINDING SITE OF DIPEPTIDYL PEPTIDASE IV (DP IV) PROSIDION LTD. (GB) 2004-04-15 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 (4 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-20030148961-A1 Peptidyl ketones as inhibitors of DPIV GLS, SLC5A1, BCKDK DPP4 60/4885DPP8 170/4885DPP9 149/4885
US-20060189523-A1 Use of effectors of glutaminyl and glutamate cyclases GLS, GLUL, GLS2 DPP4 1981/4885DPP8 3636/4885DPP9 2668/4885
US-20090149394-A1 USE OF EFFECTORS OF GLUTAMINYL AND GLUTAMATE CYCLASES GLS, GLUL, GLS2 DPP4 1981/4885DPP8 3636/4885DPP9 2668/4885
US-20040224875-A1 Inhibitors of glutaminyl cyclase GLS2, GLS, GLUL DPP4 2056/4885DPP8 2739/4885DPP9 1376/4885

“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.