Bromide

Bromide

SCHEMBL1674572

C=Cc1cc[n+](CCCC)cc1.[Br-]

nearest known ligand 0.53

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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 3/20 0.44
CHRM2 known ✓ P08172 3/20 0.44
CHRM1 known ✓ P11229 3/20 0.44
CHRM4 known ✓ P08173 2/20 0.44
CHRM5 known ✓ P08912 2/20 0.44
CHRM3 known ✓ P20309 2/20 0.44
OPRM1 known ✓ P35372 1/20 0.41
HTT P42858 4/20 0.53
KMT2A Q03164 4/20 0.53
HSP90AA1 P07900 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
MEN1 O00255 3/20 0.53
MAPT P10636 2/20 0.53
APAF1 O14727 2/20 0.53
MAPK1 P28482 2/20 0.53
BLM P54132 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48

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
Water SCHEMBL11152895 0.98 HTT (0.51) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
SCHEMBL4653273 0.98 HTT (0.50) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL4653285 0.96 HTT (0.49) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
Bromide SCHEMBL9819629 0.92 KMT2A (0.63) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
Bromide SCHEMBL3703072 0.92 KMT2A (0.63) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
Bromide SCHEMBL5586546 0.92 KMT2A (0.63) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
Bromide SCHEMBL692643 0.92 KMT2A (0.63) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
Styrene SCHEMBL11144225 0.91 HSP90AA1 (0.49) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
SCHEMBL2786767 0.90 KMT2A (0.62) HTTKMT2AHSP90AA1SMN1; SMN2MEN1
SCHEMBL3392127 0.90 KMT2A (0.62) HTTKMT2AHSP90AA1SMN1; SMN2MEN1

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006109311-A2 ENZYME-CHANNELING BASED ELECTROCHEMICAL BIOSENSORS RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2006-10-19 WO claimed
US-4745097-A SUBBING LAYER, CATIONIC POLYMER FUJI PHOTO FILM CO., LTD. (JP) 1988-05-17 US claimed
US-3957605-A POLY(ETHYLENE OXIDE), HYDROPHILIC GELS UNION CARBIDE CORPORATION (US) 1976-05-18 US claimed
US-8647669-B2 Dosage forms for tamper prone therapeutic agents ATLANTIC PHARMACEUTICALS, INC. (US) 2014-02-11 US disclosed
US-20130224265-A1 Dosage Forms for Tamper Prone Therapeutic Agents ATLANTIC PHARMACEUTICALS, INC. (US) 2013-08-29 US disclosed
US-8507001-B2 Dosage forms for tamper prone therapeutic agents ATLANTIC PHARMACEUTICALS, INC. (US) 2013-08-13 US disclosed
US-20130095148-A1 Dosage Forms for Tamper Prone Therapeutic Agents ATLANTIC PHARMACEUTICALS, INC. (US) 2013-04-18 US disclosed
US-8349362-B2 Dosage forms for tamper prone therapeutic agents ATLANTIC PHARMACEUTICALS, INC. (US) 2013-01-08 US disclosed
US-20120207797-A1 DOSAGE FORMS FOR TAMPER PRONE THERAPEUTIC AGENTS ATLANTIC PHARMACEUTICALS, INC. (US) 2012-08-16 US disclosed
US-20120171087-A1 Methods for Facilitating Fluid Flow Through Nanoporous Membranes SIMPORE, INC. (US) 2012-07-05 US disclosed
US-8187636-B2 Drug and a trap; retards the rate of release of the drug from the dosage form when the dosage form has been tampered with; opiods ATLANTIC PHARMACEUTICALS, INC. (US) 2012-05-29 US disclosed
US-4304563-A SHAMPOO OR CONDITIONER TO PREVENT OILY HAIR SOCIETE ANONYNE DITE: L'OREAL (FR) 1981-12-08 US disclosed
US-4240450-A HAIR CONDITIONER OF ANIONIC POLYMERS AND CATIONIC POLYMERS L'OREAL (FR) 1980-12-23 US disclosed
US-4238334-A Purification of liquids with treated filter aid material and active particulate material ECODYNE CORPORATION (US) 1980-12-09 US disclosed
US-4190532-A REMOVAL OF IMPURITIES FROM LIQUIDS ECODYNE CORPORATION (US) 1980-02-26 US disclosed
US-4177142-A CLUMPING ECODYNE CORPORATION (US) 1979-12-04 US disclosed
US-3993551-A POLYETHYLENE OXIDE; USEFUL AS ABSORBENT ARTICLES UNION CARBIDE CORPORATION (US) 1976-11-23 US disclosed
US-3993552-A POLYETHYLENE OXIDE;USEFUL AS ABSORBING MEDIA UNION CARBIDE CORPORATION (US) 1976-11-23 US disclosed
US-3993553-A POLYETHYLENE OXIDE;USEFUL AS ABSORBING MEDIA UNION CARBIDE CORPORATION (US) 1976-11-23 US disclosed
US-3957605-A POLY(ETHYLENE OXIDE), HYDROPHILIC GELS UNION CARBIDE CORPORATION (US) 1976-05-18 US disclosed