Bromide

Bromide

SCHEMBL28502358

CS(=O)(=O)c1ccc([Mg+])cc1.[Br-]

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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 2)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 2/20 0.54
▸ PTGS2 P35354 6/20 0.45

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
SCHEMBL2376239 0.83 ENPP2 (0.72) ENPP2PTGS2
SCHEMBL8122557 0.76 ENPP2 (0.56) ENPP2PTGS2
SCHEMBL7677302 0.75 PTGS2 (0.62) ENPP2PTGS2
SCHEMBL10300269 0.75 PTGS2 (0.62) ENPP2PTGS2
SCHEMBL17548700 0.75 ENPP2 (0.62) ENPP2PTGS2
Water SCHEMBL27483474 0.74 ENPP2 (0.54) ENPP2PTGS2
SCHEMBL28182477 0.72 GAA (0.65) ENPP2PTGS2
SCHEMBL517832 0.72 ENPP2 (0.59) ENPP2PTGS2
SCHEMBL12807 0.72 GAA (0.65) ENPP2PTGS2
Water SCHEMBL17653839 0.70 GAA (0.62) ENPP2PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117185972-B Preparation method of florfenicol intermediate 苏州开元民生科技股份有限公司 2024-02-13 — — CN claimed
CN-117185972-A Preparation method of florfenicol intermediate 苏州开元民生科技股份有限公司 2023-12-08 — — CN claimed
CN-109678811-B Asymmetric preparation method of florfenicol intermediate cyclic compound 湖北中牧安达药业有限公司 2020-12-29 — — CN claimed
CN-117185972-B Preparation method of florfenicol intermediate 苏州开元民生科技股份有限公司 2024-02-13 — — CN disclosed
CN-117185972-B Preparation method of florfenicol intermediate 苏州开元民生科技股份有限公司 2024-02-13 — — CN disclosed
CN-117185972-A Preparation method of florfenicol intermediate 苏州开元民生科技股份有限公司 2023-12-08 — — CN disclosed
CN-117185972-A Preparation method of florfenicol intermediate 苏州开元民生科技股份有限公司 2023-12-08 — — CN disclosed
CN-109678811-B Asymmetric preparation method of florfenicol intermediate cyclic compound 湖北中牧安达药业有限公司 2020-12-29 — — CN disclosed
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