Bromide

Bromide

SCHEMBL20187948

Br.Nc1nnc(-c2cccs2)n1-c1ccccc1C(F)(F)F

nearest known ligand 0.49

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
ACHE known ✓ P22303 1/20 0.37
APLNR P35414 5/20 0.49
HSD17B10 Q99714 4/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 4/20 0.41
TSHR P16473 2/20 0.41
MAPK1 P28482 1/20 0.41
HCAR1 Q9BXC0 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.36
CCNE2 O96020 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36
GAA P10253 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA2B P29275 1/20 0.36
ADORA1 P30542 1/20 0.36
LIMK1 P53667 1/20 0.35

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
SCHEMBL20207539 0.99 APLNR (0.50) APLNRHSD17B10KDM4EALDH1A1TSHR
SCHEMBL20167158 0.78 HSD11B1 (0.49) KDM4EALDH1A1HCAR1L3MBTL1HSD11B1
SCHEMBL17298109 0.75 APLNR (0.74) APLNRHSD17B10KDM4EALDH1A1TSHR
SCHEMBL20189481 0.75 APLNR (0.69) APLNRHSD17B10KDM4EALDH1A1TSHR
Hydrochloric Acid SCHEMBL31608490 0.74 APLNR (0.73) APLNRHSD17B10KDM4EALDH1A1TSHR
Hydrochloric Acid SCHEMBL19095396 0.74 APLNR (0.73) APLNRHSD17B10KDM4EALDH1A1TSHR
SCHEMBL20207351 0.70 PTGS2 (0.48) APLNRHSD17B10KDM4ETSHRSMN1; SMN2
SCHEMBL20207356 0.69 APLNR (0.49) APLNRHSD17B10KDM4ETSHRSMN1; SMN2
SCHEMBL20187769 0.66 APLNR (1.00) APLNRHSD17B10KDM4EALDH1A1TSHR
SCHEMBL20189941 0.66 APLNR (1.00) APLNRHSD17B10KDM4EALDH1A1TSHR

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
US-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AMGEN INC. (US) 2021-06-29 US disclosed
EP-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 EP disclosed
EP-3541805-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS Amgen Inc. (US) 2019-09-25 EP disclosed
WO-2018097945-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC. (US) 2018-05-31 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 (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-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AGTR1, AGTR2, TBXA2R ACHE 4184/4885APLNR 13/4885HSD17B10 1173/4885

“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.