Bromide

Bromide

SCHEMBL11534772

Br.Br.CC(N)C(=O)NC(CF)CCCN

nearest known ligand 0.41

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 12)

geneUniProtsupporting neighboursconfidence
▸ DPP7 Q9UHL4 6/20 0.41
▸ DPP8 Q6V1X1 5/20 0.41
▸ DPP4 P27487 2/20 0.38
▸ DPP9 Q86TI2 4/20 0.37
▸ SLC15A1 P46059 1/20 0.37
▸ CTRB1 P17538 5/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ NOD1 Q9Y239 1/20 0.33
▸ GNAI3 P08754 1/20 0.33
▸ GNAO1 P09471 1/20 0.33
▸ GNAI1 P63096 1/20 0.33
▸ GSR P00390 1/20 0.32

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
SCHEMBL18132889 0.84 DPP7 (0.44) DPP7DPP8DPP4DPP9SLC15A1
Bromide SCHEMBL11534511 0.84 DPP7 (0.39) DPP7DPP8DPP4SLC15A1CTRB1
SCHEMBL19882987 0.82 DPP4 (0.48) DPP7DPP8DPP4DPP9SLC15A1
SCHEMBL11532872 0.79 PLA2G2C (0.39) DPP7DPP8DPP4DPP9GSR
SCHEMBL11538163 0.75 CPB2 (0.33) DPP7DPP8DPP4DPP9GSR
SCHEMBL11192511 0.74 DPP4 (0.41) DPP7DPP8DPP4DPP9SLC15A1
SCHEMBL29674589 0.72 NOD1 (0.56) DPP7DPP8DPP4NOD1GSR
SCHEMBL27793444 0.72 NOD1 (0.56) DPP7DPP8DPP4NOD1GSR
SCHEMBL29406243 0.72 NOD1 (0.56) DPP7DPP8DPP4NOD1GSR
SCHEMBL27793445 0.72 NOD1 (0.56) DPP7DPP8DPP4NOD1GSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4134918-A ENZYME INHIBITORS, ANTIBODY INHIBITORS MERRELL TORAUDE ET COMPAGNIE (FR) 1979-01-16 — — US disclosed
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