Bromide

Bromide

SCHEMBL7050985

CCOC(=O)C[n+]1cccc(C(=O)NCCO)c1.[Br-]

nearest known ligand 0.51

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 16)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.39
GLA P06280 1/20 0.51
POLB P06746 2/20 0.48
HTT P42858 1/20 0.46
HSP90AA1 P07900 3/20 0.41
BACE1 P56817 2/20 0.41
KMT2A Q03164 2/20 0.41
PABPC1 P11940 1/20 0.41
ATM Q13315 1/20 0.41
MMP13 P45452 1/20 0.41
BCHE P06276 1/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL7509456 0.99 GLA (0.49) GLAPOLBHTTHSP90AA1BACE1
Bromide SCHEMBL1193730 0.85 GLA (0.58) GLAPOLBHTTHSP90AA1BACE1
SCHEMBL7624559 0.84 GLA (0.56) GLAPOLBHTTHSP90AA1BACE1
SCHEMBL7506380 0.82 HSP90AA1 (0.43) POLBHTTHSP90AA1BACE1KMT2A
Hydrochloric Acid SCHEMBL7048253 0.81 HSP90AA1 (0.45) POLBHSP90AA1BACE1ATMBCHE
Bromide SCHEMBL7052966 0.80 KMT2A (0.58) GLAPOLBKMT2APABPC1ATM
Bromide SCHEMBL1194002 0.80 GLA (0.53) GLAPOLBHTTHSP90AA1KMT2A
SCHEMBL14621510 0.79 GLA (0.57) GLAPOLBHTTHSP90AA1KMT2A
Bromide SCHEMBL6225758 0.79 GLA (0.55) GLAPOLBHTTHSP90AA1BACE1
SCHEMBL7506903 0.78 KMT2A (0.56) GLAPOLBHSP90AA1KMT2APABPC1

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
EP-1304101-A1 Composition and method for use of pyridinium derivatives in cosmetic and therapeutic applications Torrent Pharmaceuticals Ltd (IN) 2003-04-23 EP claimed
US-20020103228-A1 Composition and method for use of pyridinium derivatives in cosmetic and therapeutic applications TORRENT PHARMACEUTICALS LTD. 2002-08-01 US claimed
EP-1304101-A1 Composition and method for use of pyridinium derivatives in cosmetic and therapeutic applications Torrent Pharmaceuticals Ltd (IN) 2003-04-23 EP disclosed
US-20020103228-A1 Composition and method for use of pyridinium derivatives in cosmetic and therapeutic applications TORRENT PHARMACEUTICALS LTD. 2002-08-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020103228-A1 Composition and method for use of pyridinium derivatives in cosmetic and therapeutic applications PNPO, PRDX5, PLPBP ACHE 110/4885GLA 253/4885POLB 715/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.