Bromide

Bromide

SCHEMBL603971

Br.N#CC#N.O=C1CC(O)C(=O)N1

nearest known ligand 0.41

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 11)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.41
ALDH1A1 P00352 1/20 0.37
CRBN Q96SW2 2/20 0.34
CYP19A1 P11511 1/20 0.32
IDO1 P14902 2/20 0.32
MEN1 O00255 1/20 0.32
APEX1 P27695 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DDB1 Q16531 1/20 0.30

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
SCHEMBL28114713 0.91 MAP3K14 (0.41) MAP3K14ALDH1A1CRBNCYP19A1IDO1
SCHEMBL11288 0.89
SCHEMBL15494454 0.89
Ammonia Solution, Strong SCHEMBL25176856 0.86
Hydrochloric Acid SCHEMBL3986242 0.86
Phosphine SCHEMBL22345181 0.86
SCHEMBL31244467 0.86
SCHEMBL320576 0.86
Carbimide SCHEMBL4969122 0.84 MAP3K14 (0.43) MAP3K14ALDH1A1CRBNCYP19A1IDO1
Bicarbonate SCHEMBL14918 0.82 MAP3K14 (0.44) MAP3K14ALDH1A1CRBNCYP19A1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2878376-B1 Particle agglutination in a tip ORTHO CLINICAL DIAGNOSTICS INC (US) 2021-04-21 EP disclosed
EP-2878376-A2 Particle agglutination in a tip Ortho-Clinical Diagnostics Inc (US) 2015-06-03 EP disclosed
EP-2617493-B1 Particle agglutination in a tip ORTHO CLINICAL DIAGNOSTICS INC (US) 2014-12-31 EP disclosed
EP-2617493-A2 Particle agglutination in a tip Ortho Clinical Diagnostics Inc. (US) 2013-07-24 EP disclosed
EP-2257378-B1 PARTICLE AGGLUTINATION IN A PIPETTE TIP ORTHO CLINICAL DIAGNOSTICS INC (US) 2013-07-17 EP disclosed
US-8323585-B2 Use of fluid aspiration/dispensing tip as a microcentrifuge tube ORTHO-CLINICAL DIAGNOSTICS, INC. (US) 2012-12-04 US disclosed
US-20120276654-A1 USE OF FLUID ASPIRATION/DISPENSING TIP AS A MICROCENTRIFUGE TUBE ORTHO-CLINICAL DIAGNOSTICS, INC. (US) 2012-11-01 US disclosed
US-8273297-B2 Particle agglutination in a tip ORTHO-CLINICAL DIAGNOSTICS, INC. (US) 2012-09-25 US disclosed
US-20120040446-A1 PARTICLE AGGLUTINATION IN A TIP ORTHO-CLINICAL DIAGNOSTICS, INC. (US) 2012-02-16 US disclosed
US-8048376-B2 Particle agglutination in a tip ORTHO-CLINICAL DIAGNOSTICS, INC. (US) 2011-11-01 US disclosed
WO-2009114333-A2 PARTICLE AGGLUTINATION IN A TIP ORTHO-CLINICAL DIAGNOSTICS, INC. (US) 2009-09-17 WO disclosed
EP-0934523-A4 METHOD AND APPARATUS USEFUL FOR DETECTING BLOODGROUP ANTIGENS AND ANTIBODIES GAMMA BIOLOGICALS INC (US) 2002-01-23 EP disclosed
EP-0934523-A1 METHOD AND APPARATUS USEFUL FOR DETECTING BLOODGROUP ANTIGENS AND ANTIBODIES GAMMA BIOLOGICALS, INC. (US) 1999-08-11 EP disclosed
US-5905028-A SAMPLING ERYTHROCYTES, INCUBATING IN TUBE WITH IMMUNOREACTIVE PARTICLE LAYERS, CENTRIFUGING TO PELLET NONREACTIVE CELLS, CORRELATING ATTACHMENT WITH SEROTYPE GAMMA BIOLOGICALS, INC. (US) 1999-05-18 US disclosed
WO-1998016831-A1 METHOD AND APPARATUS USEFUL FOR DETECTING BLOODGROUP ANTIGENS AND ANTIBODIES GAMMA BIOLOGICALS, INC. (US) 1998-04-23 WO disclosed
WO-1998016832-A1 METHOD AND APPARATUS USEFUL FOR DETECTING BLOODGROUP ANTIGENS AND ANTIBODIES GAMMA BIOLOGICALS, INC. (US) 1998-04-23 WO disclosed
US-5665558-A Method and apparatus useful for detecting bloodgroup antigens and antibodies GAMMA BIOLOGICALS, INC. (US) 1997-09-09 US disclosed
EP-0760953-A1 METHOD AND APPARATUS USEFUL FOR DETECTING BLOODGROUP ANTIGENS AND ANTIBODIES GAMMA BIOLOGICALS, INC. (US) 1997-03-12 EP disclosed
WO-1995031731-A9 METHOD AND APPARATUS USEFUL FOR DETECTING BLOODGROUP ANTIGENS AND ANTIBODIES 1995-12-28 WO disclosed
WO-1995031731-A1 METHOD AND APPARATUS USEFUL FOR DETECTING BLOODGROUP ANTIGENS AND ANTIBODIES GAMMA BIOLOGICALS, INC. (US) 1995-11-23 WO disclosed