Bromide

Bromide

SCHEMBL7822641

Br.CSc1sc(C(=O)O)cc1-c1csc(Nc2ccc(N(C)C)cc2)n1

nearest known ligand 0.77

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 2)

geneUniProtsupporting neighboursconfidence
PLAU P00749 19/20 0.77
AMY1A P0DUB6 1/20 0.55

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 SCHEMBL6925483 0.92 PLAU (0.74) PLAUAMY1A
SCHEMBL7241402 0.91 PLAU (0.75) PLAUAMY1A
Bromide SCHEMBL7414776 0.89 PLAU (0.77) PLAU
SCHEMBL6921616 0.87 PLAU (1.00) PLAU
Hydrochloric Acid SCHEMBL6925329 0.86 PLAU (0.98) PLAU
Bromide SCHEMBL7388801 0.84 PLAU (0.79) PLAU
Bromide SCHEMBL7814603 0.84 PLAU (0.79) PLAU
Bromide SCHEMBL7827634 0.84 PLAU (0.79) PLAU
Bromide SCHEMBL7387956 0.84 PLAU (0.64) PLAU
Bromide SCHEMBL7477678 0.83 PLAU (0.78) PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1152759-A2 METHODS OF TREATING C1s-MEDIATED DISEASES AND CONDITIONS, AND COMPOUNDS AND COMPOSITIONS THEREFOR 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2001-11-14 EP disclosed
WO-2000047194-A9 METHODS OF TREATING C1s-MEDIATED DISEASES AND CONDITIONS, AND COMPOUNDS AND COMPOSITIONS THEREFOR DIMENSIONAL PHARM INC (US) 2001-05-31 WO disclosed
WO-2000047194-A2 METHODS OF TREATING C1s-MEDIATED DISEASES AND CONDITIONS, AND COMPOUNDS AND COMPOSITIONS THEREFOR 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2000-08-17 WO disclosed