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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 9/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TYR | P14679 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 SCHEMBL10698646 | 0.80 | ABL1 (0.47) | ABL1NPC1HSD17B10KDM4EMAPK1 | |
| SCHEMBL10697885 | 0.78 | ABL1 (0.48) | ABL1NPC1HSD17B10KDM4EMAPK1 | |
| SCHEMBL9342819 | 0.73 | CHRM2 (0.43) | NPC1KDM4EPOLBRAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL9342807 | 0.72 | CHRM2 (0.42) | KDM4EPOLBALDH1A1HPGD | |
| SCHEMBL10698179 | 0.72 | TYR (0.45) | ABL1NPC1HSD17B10KDM4EMAPK1 | |
| SCHEMBL10699144 | 0.71 | CHRM2 (0.41) | — | |
| SCHEMBL13842881 | 0.70 | ABL1 (0.51) | ABL1NPC1HSD17B10KDM4EMAPK1 | |
| Hydrochloric Acid SCHEMBL10697142 | 0.70 | CHRM2 (0.40) | — | |
| SCHEMBL14544148 | 0.70 | WNT3A (0.40) | KDM4EPOLBL3MBTL1MEN1KMT2A | |
| SCHEMBL9835802 | 0.70 | ABL1 (0.45) | ABL1TYR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0280873-A1 | Piperidines, medicines containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-09-07 | — | — | EP | disclosed |