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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 2/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1764684 | 0.98 | DPP4 (0.46) | DPP4F2LMNAADRA2AADRA2C | |
| SCHEMBL9242052 | 0.73 | SRC (0.44) | DPP4F2LMNACYP2D6SRC | |
| SCHEMBL21723253 | 0.71 | LMNA (0.46) | LMNACYP2D6SRCALDH1A1MAPK1 | |
| SCHEMBL6421419 | 0.71 | LMNA (0.46) | LMNACYP2D6SRCALDH1A1MAPK1 | |
| SCHEMBL9036 | 0.71 | LMNA (0.46) | LMNACYP2D6SRCALDH1A1MAPK1 | |
| Benzene SCHEMBL23120173 | 0.71 | LMNA (0.46) | LMNACYP2D6SRCALDH1A1MAPK1 | |
| SCHEMBL15941285 | 0.71 | LMNA (0.46) | LMNACYP2D6SRCALDH1A1MAPK1 | |
| Cyclopentane SCHEMBL8817783 | 0.71 | GAA (0.43) | LMNAHIF1AKDM4ECYP2D6SRC | |
| SCHEMBL22470066 | 0.70 | LMNA (0.44) | LMNACYP2D6SRCALDH1A1MAPK1 | |
| SCHEMBL20723592 | 0.70 | LMNA (0.44) | LMNACYP2D6SRCALDH1A1MAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997009333-A1 | NOVEL THIO-PHOSPHOORGANIC COMPOUNDS WITH PLANT PROTECTING ACTIVITY | SITRA FOUNDATION (FI) | 1997-03-13 | — | — | WO | disclosed |