Bromide

Bromide

SCHEMBL7801129

Br.O=C(O)CC(=O)CBr

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1582020 0.97
SCHEMBL2706065 0.79
Malonic Acid SCHEMBL28252329 0.76 TSHR (0.77)
SCHEMBL28522 0.75 LDHA (0.67)
Bromoacetic Acid SCHEMBL440556 0.75
SCHEMBL2184678 0.75 LDHA (0.67)
SCHEMBL11345455 0.73
SCHEMBL320091 0.72 LDHA (0.61)
SCHEMBL320485 0.72 LDHA (0.61)
SCHEMBL11603188 0.72 LDHA (0.61)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0484966-B1 7-Acyl-3-(substituted carbamoyloxy) cephem compounds, use thereof and process for their preparation EISAI CO LTD (JP) 2001-04-11 EP disclosed
EP-1074554-A2 7-acyl-3-(substituted carbamoyloxy) cephem compounds, use thereof and process for their preparation Eisai Co., Ltd. (JP) 2001-02-07 EP disclosed
EP-1074553-A1 7-Acyl-3-(substituted carbamoyloxy) cephem compounds, use thereof and process for their preparation Eisai Co., Ltd. (JP) 2001-02-07 EP disclosed
US-5741902-A INTERMEDIATES FOR CEPHEM ANTIBACTERIAL COMPOUNDS EISAI CO., LTD. (JP) 1998-04-21 US disclosed
EP-0761671-A1 Cephem derivatives Eisai Co., Ltd. (JP) 1997-03-12 EP disclosed
US-5604217-A CEPHALOSPORIN ANTIBIOTICS EISAI CO., LTD. (JP) 1997-02-18 US disclosed
US-5587473-A BLOCKING; CONDENSATION; DEBLOCKING EISAI CO., LTD. (JP) 1996-12-24 US disclosed
US-5563265-A BACTERICIDES EISAI CO., LTD. (JP) 1996-10-08 US disclosed
US-5559225-A ANTIBIOTICS EISAI CO., LTD. (JP) 1996-09-24 US disclosed
EP-0484966-A2 7-Acyl-3-(substituted carbamoyloxy) cephem compounds, use thereof and process for their preparation Eisai Co., Ltd. (JP) 1992-05-13 EP disclosed