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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 2/20 | 0.41 |
| ▸ | DPP4 | P27487 | 9/20 | 0.54 |
| ▸ | PREP | P48147 | 1/20 | 0.54 |
| ▸ | FAP | Q12884 | 1/20 | 0.54 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.54 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.54 |
| ▸ | ACE | P12821 | 2/20 | 0.44 |
| ▸ | HTR7 | P34969 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL9464510 | 1.00 | DPP4 (0.54) | DPP4PREPFAPDPP8DPP9 | |
| SCHEMBL8772871 | 0.98 | DPP4 (0.56) | DPP4PREPFAPDPP8DPP9 | |
| SCHEMBL8772866 | 0.98 | DPP4 (0.56) | DPP4PREPFAPDPP8DPP9 | |
| Hydrochloric Acid SCHEMBL19692659 | 0.96 | DPP4 (0.54) | DPP4PREPFAPDPP8DPP9 | |
| Hydrochloric Acid SCHEMBL29548868 | 0.96 | DPP4 (0.54) | DPP4PREPFAPDPP8DPP9 | |
| SCHEMBL10884099 | 0.84 | DPP4 (0.54) | DPP4ACEHTR1AHTR7 | |
| Glycyl Proline SCHEMBL155067 | 0.83 | ACE (0.62) | DPP4PREPFAPDPP8DPP9 | |
| Glycyl Proline SCHEMBL30051559 | 0.83 | ACE (0.62) | DPP4PREPFAPDPP8DPP9 | |
| SCHEMBL1493753 | 0.83 | DPP4 (0.47) | DPP4ACEHTR1AHTR7 | |
| Glycyl Proline SCHEMBL155066 | 0.83 | ACE (0.62) | DPP4PREPFAPDPP8DPP9 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0294668-B1 | (2-CYANO-2-OXIMINOACETYL)-AMINO ACID DERIVATIVES | BAYER AG (DE) | 1993-04-07 | — | — | EP | disclosed |
| EP-0294667-B1 | (2-CYANO-2-OXIMINOACETYL)-AMINO ACID DERIVATIVES | BAYER AG (DE) | 1993-03-17 | — | — | EP | disclosed |
| US-5189061-A | Fungicide | BAYER AKTIENGESELLSCHAFT (DE) | 1993-02-23 | — | — | US | disclosed |
| US-5026710-A | Fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1991-06-25 | — | — | US | disclosed |
| US-4963548-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1990-10-16 | — | — | US | disclosed |
| EP-0294668-A2 | (2-cyano-2-oximinoacetyl)-amino acid derivatives | BAYER AG (DE) | 1988-12-14 | — | — | EP | disclosed |
| EP-0294667-A2 | (2-cyano-2-oximinoacetyl)-amino acid derivatives | BAYER AG (DE) | 1988-12-14 | — | — | EP | disclosed |