Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 10/20 | 0.67 |
| ▸ | NPC1 | O15118 | 9/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6957065 | 0.96 | RAB9A (0.71) | RAB9ANPC1SMN1; SMN2MAPTTP53 | |
| SCHEMBL8278826 | 0.88 | RAB9A (0.65) | RAB9ANPC1SMN1; SMN2MAPTTP53 | |
| SCHEMBL12362460 | 0.84 | RAB9A (0.69) | RAB9ANPC1SMN1; SMN2MAPTTP53 | |
| SCHEMBL2247920 | 0.80 | RAB9A (1.00) | RAB9ANPC1SMN1; SMN2MAPTTP53 | |
| SCHEMBL1059693 | 0.80 | RAB9A (0.64) | RAB9ANPC1SMN1; SMN2MAPTLMNA | |
| SCHEMBL4146754 | 0.79 | RAB9A (0.58) | RAB9ANPC1SMN1; SMN2MAPTTP53 | |
| SCHEMBL757031 | 0.78 | RAB9A (0.62) | RAB9ANPC1SMN1; SMN2MAPTLMNA | |
| SCHEMBL30037937 | 0.78 | RAB9A (0.62) | RAB9ANPC1SMN1; SMN2MAPTLMNA | |
| SCHEMBL15800270 | 0.78 | RAB9A (0.60) | RAB9ANPC1SMN1; SMN2MAPTTP53 | |
| SCHEMBL285358 | 0.77 | RAB9A (0.60) | RAB9ANPC1SMN1; SMN2MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6689928-B2 | PREPARED IN SITU FROM A NICKEL, PALLADIUM OR PLATIINUM COMPOUND AND A NITROGEN-CONTAINING LIGAND; OLIGOMERIZING OLEFIN MONOMERS | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY | 2004-02-10 | — | — | US | disclosed |