Bromide

Bromide

SCHEMBL4986289

Br.NCCC[C@H](NC(=O)c1cccn(C(c2ccccc2)c2ccccc2)c1=O)C(=O)O

nearest known ligand 0.46

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 9)

geneUniProtsupporting neighboursconfidence
C3AR1 Q16581 11/20 0.46
PYGL P06737 1/20 0.37
CPB2 Q96IY4 1/20 0.37
ERAP2 Q6P179 2/20 0.36
LNPEP Q9UIQ6 2/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
ERAP1 Q9NZ08 1/20 0.36
BDKRB2 P30411 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
Bromide SCHEMBL4992858 1.00 C3AR1 (0.46) C3AR1PYGLCPB2ERAP2LNPEP
SCHEMBL4433904 0.99 C3AR1 (0.47) C3AR1PYGLCPB2ERAP2LNPEP
SCHEMBL5134378 0.99 C3AR1 (0.47) C3AR1PYGLCPB2ERAP2LNPEP
SCHEMBL4439606 0.96 C3AR1 (0.46) C3AR1PYGLCPB2ERAP2LNPEP
SCHEMBL4992916 0.92 C3AR1 (0.44) C3AR1
SCHEMBL4430852 0.89 C3AR1 (0.46) C3AR1
SCHEMBL14090933 0.89 CNR2 (0.46) C3AR1ERAP2LNPEPERAP1
SCHEMBL27793101 0.88 C3AR1 (0.46) C3AR1PYGLCPB2ERAP2LNPEP
SCHEMBL27772086 0.88 C3AR1 (0.48) C3AR1PYGLCPB2ERAP2LNPEP
SCHEMBL4437670 0.86 KMT2A (0.46) C3AR1PYGLMMP2MMP9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080188528-A1 Modulators of C3a receptor and methods of use thereof ENCYSIVE PHARMACEUTICALS, INC. 2008-08-07 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-20080188528-A1 Modulators of C3a receptor and methods of use thereof C3AR1, C5, C5AR1 C3AR1 1/4885PYGL 1070/4885CPB2 359/4885

“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.