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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.35 |
| ▸ | MEN1 | O00255 | 5/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPY1R | P25929 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29430132 | 0.98 | ALDH1A1 (0.42) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL20390457 | 0.87 | ALDH1A1 (0.40) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL14850036 | 0.83 | ALDH1A1 (0.54) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL3485083 | 0.81 | ALDH1A1 (0.41) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL12388029 | 0.81 | ALDH1A1 (0.40) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL29430125 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL1917162 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL15158277 | 0.77 | ALDH1A1 (0.40) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL7801140 | 0.76 | ALDH1A1 (0.40) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL15930651 | 0.76 | TNF (0.42) | ALDH1A1KMT2AMEN1L3MBTL1POLB |
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-0962497-B1 | Rhodamine derivates and their use in diagnostic systems | ROCHE DIAGNOSTICS GMBH (DE) | 2001-07-18 | — | — | EP | disclosed |
| US-6184379-B1 | FLUORESCENT DYES USED IN DIAGNOSIS | ROCHE DIAGNOSTICS GMBH (DE) | 2001-02-06 | — | — | US | disclosed |
| EP-0962497-A1 | Rhodamine derivates and their use in diagnostic systems | Roche Diagnostics GmbH (DE) | 1999-12-08 | — | — | EP | disclosed |