Bromide

Bromide

SCHEMBL11549089

Br.Brc1ccc(N2CCNCC2)nc1

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 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2A known ✓ Q12879 1/20 0.50
▸ ADRB1 known ✓ P08588 1/20 0.44
▸ HTR1A known ✓ P08908 1/20 0.44
▸ SLC6A4 known ✓ P31645 1/20 0.44
▸ HTR3A known ✓ P46098 1/20 0.44
▸ PLD1 Q13393 1/20 0.51
▸ GRIN2D O15399 1/20 0.50
▸ GRIN3B O60391 1/20 0.50
▸ GRIN1 Q05586 1/20 0.50
▸ GRIN2B Q13224 1/20 0.50
▸ GRIN2C Q14957 1/20 0.50
▸ GRIN3A Q8TCU5 1/20 0.50
▸ AKR1C3 P42330 1/20 0.49
▸ CHRNB2 P17787 3/20 0.49
▸ CHRNA4 P43681 3/20 0.49
▸ BPTF Q12830 2/20 0.46
▸ GPR119 Q8TDV5 1/20 0.45
▸ HTT P42858 2/20 0.44
▸ NCF1 P14598 1/20 0.44
▸ HTR2C P28335 2/20 0.44

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
SCHEMBL578623 0.98 PLD1 (0.53) PLD1GRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL19283847 0.96 PLD1 (0.51) PLD1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL593235 0.92 CHRNB2 (0.55) PLD1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5236585 0.85 AKR1C3 (0.61) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1778499 0.82 CYP2D6 (0.60) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Tert-Butyl Formate SCHEMBL27772208 0.82 PPARG (0.43) PLD1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2255519 0.81 GRIN2D (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30020512 0.81 GRIN2D (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL742515 0.81 GRIN2D (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29219553 0.80 PPARG (0.46) PLD1GRIN2DGRIN3BGRIN1GRIN2A

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-4179563-A COGNITION ACTIVATORS WARNER-LAMBERT COMPANY (US) 1979-12-18 — — US disclosed
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