Bromide

Bromide

SCHEMBL949153

Br.Clc1ccc2c(c1)CCN2

nearest known ligand 0.62

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 20)

geneUniProtsupporting neighboursconfidence
ADRA2A known ✓ P08913 3/20 0.41
ADRA2B known ✓ P18089 3/20 0.41
ADRA2C known ✓ P18825 3/20 0.41
HTR1D known ✓ P28221 2/20 0.41
HTR3A known ✓ P46098 2/20 0.41
ACHE known ✓ P22303 1/20 0.40
ADRB1 known ✓ P08588 1/20 0.40
HTR1A known ✓ P08908 1/20 0.40
SLC6A2 known ✓ P23975 1/20 0.40
SLC6A4 known ✓ P31645 1/20 0.40
DRD4 P21917 3/20 0.62
DRD2 P14416 1/20 0.62
HTR2A P28223 7/20 0.53
HTR2C P28335 7/20 0.53
HTR2B P41595 6/20 0.53
F7 P08709 1/20 0.50
PARP1 P09874 1/20 0.50
F3 P13726 1/20 0.50
PARP10 Q53GL7 1/20 0.50
PNMT P11086 1/20 0.50

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
SCHEMBL154428 0.98 DRD4 (0.64) DRD4DRD2HTR2AHTR2CHTR2B
SCHEMBL1091532 0.86 MAPT (0.54) DRD4DRD2HTR2AHTR2CHTR2B
SCHEMBL10122766 0.84 KDM4E (0.49) DRD4DRD2HTR2AHTR2CHTR2B
SCHEMBL30839280 0.84 KDM4E (0.49) DRD4DRD2HTR2AHTR2CHTR2B
SCHEMBL549646 0.81 F7 (0.56) DRD4DRD2HTR2AHTR2CHTR2B
SCHEMBL29924038 0.81 F7 (0.56) DRD4DRD2HTR2AHTR2CHTR2B
SCHEMBL29175983 0.80 AHR (0.54) DRD4DRD2HTR2AHTR2CHTR2B
SCHEMBL17461314 0.80 AHR (0.54) DRD4DRD2HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL8645796 0.79 F7 (0.55) DRD4DRD2HTR2AHTR2CHTR2B
Ammonia Solution, Strong SCHEMBL7043924 0.79 F7 (0.55) DRD4DRD2HTR2AHTR2CHTR2B

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
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
US-20070004736-A1 Imidazole derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-04 US disclosed
EP-1564213-A1 IMIDAZOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2005-08-17 EP 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 (2 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-20070004736-A1 Imidazole derivative, process for producing the same, and use HRH4, F2, HRH2 ADRA2A 964/4885ADRA2B 906/4885ADRA2C 862/4885
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE F2, H1-3, CYC1 ADRA2A 1464/4885ADRA2B 1352/4885ADRA2C 1432/4885

“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.