Sugi Predict

Sugi Predict / Compounds / Bromide

Bromide

Bromide

SCHEMBL4690992

CCCCC=CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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
▸ HIF1A Q16665 1/20 0.39
▸ CYP1A2 P05177 4/20 0.38
▸ CYP3A4 P08684 4/20 0.38
▸ TSHR P16473 4/20 0.38
▸ CYP2C9 P11712 3/20 0.38
▸ CYP2C19 P33261 3/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ SOAT2 O75908 1/20 0.38
▸ SOAT1 P35610 1/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ EPHX2 P34913 3/20 0.36
▸ FAAH O00519 2/20 0.36
▸ BID P55957 3/20 0.35
▸ BCL2L1 Q07817 3/20 0.35
▸ MCL1 Q07820 3/20 0.35
▸ BAK1 Q16611 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ DAGLA Q9Y4D2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CNR1 P21554 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 SCHEMBL4690988 1.00 HIF1A (0.39) HIF1ACYP1A2CYP3A4TSHRCYP2C9
Bromide SCHEMBL9623514 0.93 SOAT2 (0.46) CYP3A4TSHRALDH1A1SOAT2SOAT1
Bromide SCHEMBL9623511 0.93 SOAT2 (0.46) CYP3A4TSHRALDH1A1SOAT2SOAT1
Hydrochloric Acid SCHEMBL11497139 0.90 SOAT2 (0.46) CYP3A4TSHRALDH1A1SOAT2SOAT1
Hydrochloric Acid SCHEMBL11497137 0.90 SOAT2 (0.46) CYP3A4TSHRALDH1A1SOAT2SOAT1
Bromide SCHEMBL9594082 0.89 HIF1A (0.46) HIF1ACYP1A2TSHRCYP2C19ALDH1A1
Bromide SCHEMBL9594079 0.89 HIF1A (0.46) HIF1ACYP1A2TSHRCYP2C19ALDH1A1
Formic Acid SCHEMBL11491854 0.84 SOAT2 (0.45) SOAT2SOAT1EPHX2FAAHDAGLA
Formic Acid SCHEMBL11491853 0.84 SOAT2 (0.45) SOAT2SOAT1EPHX2FAAHDAGLA
Phosphoric Acid SCHEMBL11482123 0.84 SOAT2 (0.45) SOAT2SOAT1EPHX2FAAHDAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603874-B1 G-LACTAM DERIVATIVES AS PROSTAGLANDIN AGONISTS SERONO LAB (CH) 2008-05-07 — — EP disclosed
US-7276531-B2 G-lactam derivatives as prostaglandin agonists APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2007-10-02 — — US disclosed
US-20060194865-A1 G-lactam derivatives as prostaglandin agonists APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2006-08-31 — — US disclosed
EP-1603874-A2 G-LACTAM DERIVATIVES AS PROSTAGLANDIN AGONISTS Applied Research Systems ARS Holding N.V. (AN) 2005-12-14 — — EP disclosed
WO-2004078103-A2 G-LACTAM DERIVATIVES AS PROSTAGLANDIN AGONISTS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-09-16 — — 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-20060194865-A1 G-lactam derivatives as prostaglandin agonists PTGIS, PTGIR, PTGES HIF1A 2643/4885CYP1A2 280/4885CYP3A4 481/4885

“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.