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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 6/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 4/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31104719 | 0.84 | MEN1 (0.41) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| Bromide SCHEMBL1743182 | 0.82 | ERAP1 (0.41) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| Bromide SCHEMBL893233 | 0.80 | ERAP1 (0.49) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| Bromide SCHEMBL17339130 | 0.74 | ERAP1 (0.49) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL11606548 | 0.73 | KMT2A (0.51) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| Bromide SCHEMBL7401891 | 0.73 | ERAP1 (0.48) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL17339102 | 0.72 | KMT2A (0.47) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL19700528 | 0.72 | KMT2A (0.49) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| Bromide SCHEMBL1740164 | 0.71 | ERAP1 (0.43) | ERAP1MEN1KMT2AALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL11422962 | 0.70 | KMT2A (0.48) | ERAP1MEN1KMT2AALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0450073-B1 | 1-AZAINDOLIZINE DERIVATIVE, INTERMEDIATE FOR SYNTHESIS THEREOF, AND ANTIALLERGIC CONTAINING 1-AZAINDOLIZINE DERIVATIVE | ZENYAKU KOGYO KK (JP) | 1995-03-08 | — | — | EP | disclosed |
| US-5112833-A | Dermatitis, rhinitis, asthma | ZENYAKU KOGYO KABUSHIKI KAISHA (JP) | 1992-05-12 | — | — | US | disclosed |
| EP-0450073-A1 | 1-AZAINDOLIZINE DERIVATIVE, INTERMEDIATE FOR SYNTHESIS THEREOF, AND ANTIALLERGIC CONTAINING 1-AZAINDOLIZINE DERIVATIVE | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 1991-10-09 | — | — | EP | disclosed |