Bromide

Bromide

SCHEMBL9690249

Br.CNCCn1nc(C)c2ccccc2c1=O

nearest known ligand 0.59

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
RAB9A P51151 1/20 0.59
LMNA P02545 2/20 0.55
NPSR1 Q6W5P4 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPK1 P28482 1/20 0.51
POLB P06746 2/20 0.50
HTT P42858 3/20 0.49
TSHR P16473 1/20 0.49
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL10123547 0.81 LMNA (0.60) RAB9ALMNANPSR1SMN1; SMN2MAPK1
SCHEMBL8132638 0.80 LMNA (0.59) RAB9ALMNANPSR1SMN1; SMN2MAPK1
SCHEMBL12877767 0.77 LMNA (0.64) RAB9ALMNANPSR1SMN1; SMN2MAPK1
SCHEMBL9377652 0.76 LMNA (0.55) RAB9ALMNANPSR1SMN1; SMN2MAPK1
SCHEMBL10698694 0.74 ADRA1A (0.62) LMNASMN1; SMN2TSHR
SCHEMBL24000166 0.73 ALDH1A1 (0.65) RAB9ALMNANPSR1SMN1; SMN2MAPK1
SCHEMBL6885992 0.73 LMNA (0.77) RAB9ALMNANPSR1SMN1; SMN2MAPK1
SCHEMBL10109757 0.73 LMNA (0.59) RAB9ALMNANPSR1SMN1; SMN2MAPK1
SCHEMBL12862543 0.73 LMNA (0.59) RAB9ALMNANPSR1SMN1; SMN2MAPK1
SCHEMBL3973342 0.73 NPC1 (0.58) RAB9ALMNASMN1; SMN2POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5114952-A Side effect reduction PFIZER INC. (US) 1992-05-19 US disclosed
US-4990509-A Sulfonamide anti-arrhythmic agents PFIZER INC. (US) 1991-02-05 US disclosed
US-4863948-A Isoindolinone sulfonamide anti-arrhythmic agents PFIZER, INC. (US) 1989-09-05 US disclosed
EP-0242173-A1 Antiarrhythmic agents Pfizer Limited (GB) 1987-10-21 EP disclosed