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.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bromide SCHEMBL31024397 | 1.00 | — | — | |
| SCHEMBL29653537 | 0.97 | — | — | |
| SCHEMBL113672 | 0.97 | — | — | |
| Cyanide SCHEMBL27870989 | 0.91 | ALDH1A1 (0.37) | — | |
| Formaldehyde SCHEMBL29031592 | 0.91 | P2RX7 (0.40) | — | |
| SCHEMBL29067869 | 0.85 | TRIM24 (0.42) | — | |
| Formic Acid Methyl Ester SCHEMBL29281000 | 0.82 | TRIM24 (0.40) | — | |
| Dimethylformamide SCHEMBL27472098 | 0.82 | TRIM24 (0.40) | — | |
| SCHEMBL31016865 | 0.81 | — | — | |
| Ethoxycarbonyl Group SCHEMBL27868253 | 0.76 | ALDH1A1 (0.36) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3294729-A1 | SUBSTITUTED QUINOXALINE DERIVATIVES | SELVITA S.A. (PL) | 2018-03-21 | — | — | EP | disclosed |
| WO-2016180536-A1 | SUBSTITUTED QUINOXALINE DERIVATIVES | SELVITA S.A. (PL) | 2016-11-17 | — | — | WO | disclosed |
| CN-1993346-B | Thiophene compound | ACTELION PHARMACEUTICALS LTD | 2011-04-27 | — | — | CN | disclosed |
| CN-1993346-A | Novel thiophene derivatives | ACTELION PHARMACEUTICALS LTD (CH) | 2007-07-04 | — | — | CN | disclosed |