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 2)
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8319768 | 0.98 | DHFR (0.64) | DHFRSLC2A1 | |
| SCHEMBL9068396 | 0.83 | DHFR (0.60) | DHFRSLC2A1 | |
| SCHEMBL8322799 | 0.80 | DHFR (0.51) | DHFRSLC2A1 | |
| SCHEMBL10465515 | 0.78 | DHFR (0.74) | DHFRSLC2A1 | |
| SCHEMBL5462527 | 0.78 | DHFR (0.58) | DHFRSLC2A1 | |
| SCHEMBL8322368 | 0.78 | DHFR (0.46) | DHFRSLC2A1 | |
| SCHEMBL27188510 | 0.76 | DHFR (0.52) | DHFRSLC2A1 | |
| SCHEMBL30092875 | 0.76 | DHFR (0.52) | DHFRSLC2A1 | |
| SCHEMBL9549873 | 0.74 | DHFR (0.48) | DHFRSLC2A1 | |
| SCHEMBL10052933 | 0.74 | DHFR (0.82) | DHFR |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4725687-A | ANTITUMOR AGENTS; SIDE EFFECT REDUCTION; POTENCY | SOUTHERN RESEARCH INSTITUTE (US) | 1988-02-16 | — | — | US | claimed |
| WO-1993013102-A1 | DEAZAAMINOPTERINS | SOUTHERN RESEARCH INSTITUTE (US) | 1993-07-08 | — | — | WO | disclosed |
| US-5077404-A | Cyclized 5,10-dideazaaminopterin compounds | SRI INTERNATIONAL | 1991-12-31 | — | — | US | disclosed |