Bromide

Bromide

SCHEMBL5619195

Br.N=C(N)c1ccc(Br)cc1

nearest known ligand 0.56

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
▸ LMNA P02545 2/20 0.56
▸ PLAU P00749 2/20 0.56
▸ MASP2 O00187 1/20 0.56
▸ THPO P40225 1/20 0.56
▸ PRSS1 P07477 5/20 0.54
▸ PRSS3 P35030 5/20 0.54
▸ F2 P00734 4/20 0.54
▸ APEX1 P27695 1/20 0.54
▸ NQO2 P16083 1/20 0.53
▸ F10 P00742 2/20 0.52
▸ F12 P00748 1/20 0.52
▸ F7 P08709 1/20 0.52
▸ F3 P13726 1/20 0.52
▸ PKM P14618 1/20 0.52
▸ ST14 Q9Y5Y6 2/20 0.52
▸ PRMT5 O14744 1/20 0.52
▸ PRMT1 Q99873 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52

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
SCHEMBL204318 0.97 LMNA (0.59) LMNAPLAUMASP2THPOPRSS1
Hydrochloric Acid SCHEMBL982825 0.95 PRSS1 (0.61) LMNAPLAUMASP2THPOPRSS1
Hydrochloric Acid SCHEMBL9338860 0.92 LMNA (0.54) LMNAPLAUMASP2THPOPRSS1
SCHEMBL27438192 0.90 WDR5 (0.64) LMNAPLAUMASP2THPOPRSS1
Benzamidine SCHEMBL428760 0.88 F2 (0.73) LMNAPLAUMASP2THPOPRSS1
Hydrochloric Acid SCHEMBL9391856 0.88 WDR5 (0.61) LMNAPLAUMASP2THPOPRSS1
SCHEMBL537030 0.83 LMNA (0.77) LMNAPLAUMASP2THPOPRSS1
Hydrochloric Acid SCHEMBL392375 0.80 PRSS1 (0.78) LMNAPLAUMASP2THPOPRSS1
Hydrochloric Acid SCHEMBL30999366 0.80 PRSS1 (0.78) LMNAPLAUMASP2THPOPRSS1
SCHEMBL32662891 0.75 PLAU (0.64) PLAUPRSS1F2F10F12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202243-B2 Substituted imidazotriazines BAYER HEALTHCARE AG (DE) 2007-04-10 — — US disclosed
US-20060166993-A1 Substituted imidazotriazines BAYER HEALTHCARE AG (DE) 2006-07-27 — — US disclosed
EP-1599479-A1 SUBSTITUTED IMIDAZOTRIAZINES Bayer HealthCare AG (DE) 2005-11-30 — — EP disclosed
US-6936609-B2 Imidazotriazines for use as phosphodiesterase inhibitors BAYER HEALTHCARE AG (DE) 2005-08-30 — — US disclosed
US-20040249148-A1 Imidazotriazines for use as phosphodiesterase inhibitors BAYER HEALTHCARE AG (DE) 2004-12-09 — — US disclosed
EP-1404677-A1 IMIDAZOTRIAZINES FOR USE AS PHOSPHODIESTERASE INHIBITORS Bayer HealthCare AG (DE) 2004-04-07 — — EP disclosed
WO-2004005290-A1 SUBSTITUTED IMIDAZOTRIAZINES BAYER HEALTHCARE AG (DE) 2004-01-15 — — WO disclosed
WO-2003000693-A1 IMIDAZOTRIAZINES FOR USE AS PHOSPHODIESTERASE INHIBITORS BAYER HEALTHCARE AG (DE) 2003-01-03 — — WO disclosed
US-3940395-A CNS DEPRESSANT AMERICAN HOME PRODUCTS CORPORATION (US) 1976-02-24 — — 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 (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-20060166993-A1 Substituted imidazotriazines SNCA, PARK7, TPMT LMNA 3545/4885PLAU 4740/4885MASP2 3505/4885
US-20040249148-A1 Imidazotriazines for use as phosphodiesterase inhibitors PDE3A, PDE2A, PDE4A LMNA 2027/4885PLAU 1661/4885MASP2 1949/4885

“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.

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