Bromide

Bromide

SCHEMBL8108897

Br.NCCCc1ccc(-c2ccc(=O)[nH]n2)cc1

nearest known ligand 0.69

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
CHRM2 known ✓ P08172 1/20 0.38
SLC6A2 known ✓ P23975 1/20 0.38
ADRA1A known ✓ P35348 1/20 0.38
HTR3A known ✓ P46098 1/20 0.38
SLC6A3 known ✓ Q01959 1/20 0.38
MAPT P10636 1/20 0.69
LMNA P02545 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CYP1A2 P05177 1/20 0.51
HRH3 Q9Y5N1 6/20 0.49
AKT2 P31751 1/20 0.48
PDE3B Q13370 3/20 0.46
PDE3A Q14432 3/20 0.46
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
SPNS2 Q8IVW8 2/20 0.39
NPC1 O15118 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
Bromide SCHEMBL8100497 0.95 MAPT (0.72) MAPTLMNAMEN1KMT2ACYP1A2
SCHEMBL8114174 0.94 MAPT (0.74) MAPTLMNAMEN1KMT2ACYP1A2
SCHEMBL7302713 0.89 MAPT (0.66) MAPTLMNAMEN1KMT2ACYP1A2
SCHEMBL9815929 0.81 MAPT (0.97) MAPTLMNAMEN1KMT2ACYP1A2
SCHEMBL1640658 0.80 MAPT (0.66) MAPTLMNAMEN1KMT2ACYP1A2
SCHEMBL10353474 0.80 MAPT (0.80) MAPTLMNAMEN1KMT2ACYP1A2
Bromide SCHEMBL8110043 0.79 HRH3 (0.63) MAPTLMNAMEN1KMT2ACYP1A2
Bromide SCHEMBL8100697 0.78 HRH3 (0.62) MAPTLMNAMEN1KMT2ACYP1A2
SCHEMBL9687084 0.78 MAPT (0.50) MAPTLMNAMEN1KMT2ACYP1A2
SCHEMBL3452908 0.78 LMNA (0.80) MAPTLMNAMEN1KMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0751132-B1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO (JP) 2000-08-30 EP disclosed
EP-0751132-A1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1997-01-02 EP disclosed