Bromide

Bromide

SCHEMBL10583382

Br.COc1ccc(/C=C/c2ccc3c(=O)n(CCCCN(C)C)ncc3c2)cc1

nearest known ligand 0.43

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 14)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 2/20 0.43
▸ MAOB P27338 2/20 0.43
▸ FLT3 P36888 5/20 0.41
▸ LMNA P02545 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ KAT2B Q92831 2/20 0.39
▸ APP P05067 2/20 0.38
▸ HRH3 Q9Y5N1 2/20 0.38
▸ EGFR P00533 1/20 0.38
▸ PDGFRB P09619 1/20 0.38
▸ PDGFRA P16234 1/20 0.38
▸ HASPIN Q8TF76 1/20 0.38
▸ NPBWR1 P48145 1/20 0.37
▸ ROCK2 O75116 1/20 0.36

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 SCHEMBL10583385 1.00 MAOA (0.43) MAOAMAOBFLT3LMNASMN1; SMN2
Bromide SCHEMBL10581709 0.97 FLT3 (0.42) MAOAMAOBFLT3LMNASMN1; SMN2
Bromide SCHEMBL10581715 0.97 FLT3 (0.42) MAOAMAOBFLT3LMNASMN1; SMN2
SCHEMBL10510083 0.96 FLT3 (0.43) MAOAMAOBFLT3LMNASMN1; SMN2
SCHEMBL10510092 0.96 FLT3 (0.43) MAOAMAOBFLT3LMNASMN1; SMN2
Bromide SCHEMBL10582253 0.93 KAT2B (0.41) MAOAMAOBFLT3LMNASMN1; SMN2
Bromide SCHEMBL10582244 0.93 KAT2B (0.41) MAOAMAOBFLT3LMNASMN1; SMN2
SCHEMBL10581087 0.92 KAT2B (0.42) MAOAMAOBFLT3LMNASMN1; SMN2
SCHEMBL10581084 0.92 KAT2B (0.42) MAOAMAOBFLT3LMNASMN1; SMN2
Bromide SCHEMBL10353541 0.87 EGFR (0.40) MAOAMAOBSMN1; SMN2EGFRPDGFRB

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-0309765-A2 1(2H)-Phthalazinones as cytoprotective agents FISONS CORPORATION (US) 1989-04-05 — — EP disclosed
US-4769369-A Anti-allergy 1(2H)-phthalazinones PENNWALT CORPORATION (US) 1988-09-06 — — US disclosed
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