Bromide

Bromide

SCHEMBL13387488

Br.Br.Nc1nc2c(s1)CC(N1CCCCC1)CC2

nearest known ligand 0.58

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 2/20 0.44
ADRB2 known ✓ P07550 1/20 0.44
HTR1A known ✓ P08908 1/20 0.44
ADRA2B known ✓ P18089 1/20 0.44
ADRA2C known ✓ P18825 1/20 0.44
HTR1B known ✓ P28222 1/20 0.44
ADRA1A known ✓ P35348 1/20 0.44
SIGMAR1 known ✓ Q99720 1/20 0.44
APOBEC3A P31941 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
DRD3 P35462 5/20 0.44
DRD2 P14416 5/20 0.44

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 SCHEMBL2710835 1.00 APOBEC3A (0.47) APOBEC3AAPOBEC3GLMNAPOLBGAA
SCHEMBL6032898 0.98 APOBEC3A (0.49) APOBEC3AAPOBEC3GLMNAPOLBGAA
Hydrochloric Acid SCHEMBL7325267 0.97 APOBEC3A (0.47) APOBEC3AAPOBEC3GLMNAPOLBGAA
Hydrochloric Acid SCHEMBL7315340 0.97 APOBEC3A (0.47) APOBEC3AAPOBEC3GLMNAPOLBGAA
SCHEMBL7315449 0.97 LMNA (0.48) APOBEC3AAPOBEC3GLMNAPOLBGAA
Hydrochloric Acid SCHEMBL7325859 0.95 ADRA2A (0.47) APOBEC3AAPOBEC3GLMNAPOLBGAA
SCHEMBL322162 0.88 LMNA (0.48) APOBEC3AAPOBEC3GLMNAPOLBGAA
Bromide SCHEMBL2711090 0.86 LMNA (0.44) APOBEC3AAPOBEC3GLMNAPOLBGAA
Bromide SCHEMBL309082 0.86 LMNA (0.44) APOBEC3AAPOBEC3GLMNAPOLBGAA
SCHEMBL2712761 0.85 LMNA (0.46) APOBEC3AAPOBEC3GLMNAPOLBGAA

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
EP-2630144-B1 RHO KINASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2016-09-07 EP disclosed
US-9000154-B2 Rho kinase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-04-07 US disclosed
US-20120270868-A1 RHO KINASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-10-25 US 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-20120270868-A1 RHO KINASE INHIBITORS ROCK1, ROCK2, RHOA ADRA2A 1314/4885ADRB2 1227/4885HTR1A 3203/4885

“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.