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 | |
|---|---|---|---|---|
| ▸ | PABPC1 | P11940 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11424376 | 0.97 | ATM (0.55) | PABPC1KMT2AATMLMNAKDM4E | |
| SCHEMBL22776049 | 0.83 | KMT2A (0.49) | PABPC1KMT2AATMLMNAALDH1A1 | |
| SCHEMBL14621510 | 0.81 | GLA (0.57) | PABPC1KMT2AATMALDH1A1GLA | |
| Bromide SCHEMBL11489914 | 0.81 | GLA (0.53) | PABPC1KMT2AATMLMNAKDM4E | |
| Bromide SCHEMBL7352865 | 0.80 | GLA (0.52) | PABPC1KMT2AATMLMNAKDM4E | |
| Bromide SCHEMBL344154 | 0.79 | KMT2A (0.50) | KMT2AKDM4EALDH1A1GLAHTT | |
| Hydrochloric Acid SCHEMBL11490843 | 0.78 | GLA (0.50) | PABPC1KMT2AATMLMNAKDM4E | |
| Bromide SCHEMBL1193574 | 0.78 | GLA (0.70) | PABPC1KMT2AATMLMNAKDM4E | |
| SCHEMBL8971275 | 0.78 | ALDH1A1 (0.45) | KMT2ALMNAKDM4EALDH1A1HTT | |
| SCHEMBL13936711 | 0.78 | PABPC1 (0.68) | PABPC1KMT2AATMLMNAKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-58216185-A | — | — | None | — | — | JP | disclosed |
| JP-S58216185-A | NICOTINE DERIVATIVE | JAPAN TOBACCO INC | 1983-12-15 | — | — | JP | disclosed |