Bromide

Bromide

SCHEMBL5550586

Br.CCCCCCCCCCN(CCCCCl)CCCCCCCCCC

nearest known ligand 0.65

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 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.65
ALDH1A1 P00352 1/20 0.65
DNM1 Q05193 4/20 0.50
TDP1 Q9NUW8 1/20 0.48
THRB P10828 1/20 0.40
KCNH2 Q12809 3/20 0.39
KDM5A P29375 2/20 0.38
PHF8 Q9UPP1 2/20 0.38
KDM4C Q9H3R0 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37

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 SCHEMBL5551000 1.00 TSHR (0.65) TSHRALDH1A1DNM1TDP1THRB
Bromide SCHEMBL8490443 1.00 TSHR (0.65) TSHRALDH1A1DNM1TDP1THRB
SCHEMBL1883604 0.97 TSHR (0.68) TSHRALDH1A1DNM1TDP1THRB
SCHEMBL1885691 0.97 TSHR (0.68) TSHRALDH1A1DNM1TDP1THRB
SCHEMBL28337020 0.97 TSHR (0.68) TSHRALDH1A1DNM1TDP1THRB
SCHEMBL28571943 0.92 TSHR (0.60) TSHRALDH1A1DNM1TDP1THRB
SCHEMBL28573267 0.92 TSHR (0.60) TSHRALDH1A1DNM1TDP1THRB
SCHEMBL6945510 0.92 TSHR (0.60) TSHRALDH1A1DNM1TDP1KCNH2
SCHEMBL21842845 0.92 TSHR (0.60) TSHRALDH1A1DNM1TDP1THRB
SCHEMBL28820796 0.92 TSHR (0.60) TSHRALDH1A1DNM1TDP1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070190021-A1 Poly(diallylamine)-based bile acid sequestrants HOLMES-FARLEY STEPHEN R 2007-08-16 US disclosed
US-7125547-B2 Poly(diallylamine)-based bile acid sequestrants GENZYME CORPORATION (US) 2006-10-24 US disclosed
EP-1014999-B1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GENZYME CORP (US) 2004-12-08 EP disclosed
US-20040151687-A1 Poly(diallylamine)-based bile acid sequestrants GENZYME CORPORATION 2004-08-05 US disclosed
US-6726905-B1 LOWERING SERUM PHOSPHATE GENZYME CORPORATION 2004-04-27 US disclosed
US-6692732-B2 Administering cationic polymers to mammals to prevent poisons or antigens from microorganisms such as bacteria, viruses, fungi or parasites; deactivation GENZYME CORPORATION 2004-02-17 US disclosed
US-20040009145-A1 IONIC POLYMERS AS TOXIN-BINDING AGENTS GELTEX PHARMACEUTICALS, INC. 2004-01-15 US disclosed
US-6610283-B1 Method for removing bile acids from a patient and certain polymers of use in the method. The method comprises the step of administering to the patient a therapeutically effective amount of a polymer composition which includes a a GENZYME CORPORATION 2003-08-26 US disclosed
US-20020114774-A1 Ionic polymers as toxin-binding agents GELTEX PHARMACEUTICALS, INC. 2002-08-22 US disclosed
US-6290947-B1 IN ONE EMBODIMENT, THE POLYMER IS A COPOLYMER COMPRISING A MONOMER HAVING A PENDANT AMMONIUM GROUP AND A HYDROPHOBIC MONOMER. GELTEX PHARMACEUTICALS, INC. 2001-09-18 US disclosed
US-6203785-B1 ADMINISTERING CROSSLINKED CATIONIC POLYMER ANTICHOLESTEROL AGENTS GELTEX PHARMACEUTICALS, INC. 2001-03-20 US disclosed
US-6007803-A ADMINISTERING TO MAMMAL A CATIONIC POLYMER TO INHIBIT PATHOGENIC TOXINS GELTEX PHARMACEUTICALS, INC. (US) 1999-12-28 US disclosed
US-5969090-A QUATERNIZED CROSSLINKED HYDROCARBON AMINE POLYMER GELTEX PHARMACEUTICALS, INC. (US) 1999-10-19 US disclosed
US-5900475-A MODIFIED POLYALLYLAMINE; ANTICHOLESTEROL AGENT GELTEX PHARMACEUTICALS, INC. (US) 1999-05-04 US disclosed
EP-0830390-A1 HYDROPHOBIC HETEROATOM-CONTAINING SEQUESTRANT FOR CHOLESTEROL DEPLETION GELTEX PHARMACEUTICALS, INC. (US) 1998-03-25 EP disclosed
WO-1996039449-A1 HYDROPHOBIC HETEROATOM-CONTAINING SEQUESTRANT FOR CHOLESTEROL DEPLETION GELTEX PHARMACEUTICALS, INC. (US) 1996-12-12 WO 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 (4 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-20070190021-A1 Poly(diallylamine)-based bile acid sequestrants NR1H4, SLC10A2, SLC10A1 TSHR 4075/4885ALDH1A1 2873/4885DNM1 3581/4885
US-20040151687-A1 Poly(diallylamine)-based bile acid sequestrants NR1H4, SLC10A2, SLC10A1 TSHR 4388/4885ALDH1A1 2717/4885DNM1 3469/4885
US-20020114774-A1 Ionic polymers as toxin-binding agents PIGS, ANTXR2, MSN TSHR 622/4885ALDH1A1 4693/4885DNM1 424/4885
US-20040009145-A1 IONIC POLYMERS AS TOXIN-BINDING AGENTS PIGS, ANTXR2, MSN TSHR 622/4885ALDH1A1 4693/4885DNM1 424/4885

“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.