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 | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | LOX | P28300 | 2/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.45 |
| ▸ | NPY1R | P25929 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | FGB | P02675 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9589105 | 0.98 | L3MBTL1 (0.54) | L3MBTL1POLBCYP19A1LOXLOXL2 | |
| SCHEMBL9080937 | 0.82 | CYP3A4 (0.57) | L3MBTL1POLBLMNACA1CA2 | |
| SCHEMBL9587487 | 0.80 | L3MBTL1 (0.50) | L3MBTL1CYP19A1LOXLOXL2MAOA | |
| SCHEMBL1952494 | 0.78 | LMNA (0.68) | L3MBTL1LOXLOXL2MAOALMNA | |
| SCHEMBL9587481 | 0.78 | L3MBTL1 (0.47) | L3MBTL1POLBCYP19A1LOXLOXL2 | |
| SCHEMBL9586629 | 0.78 | LOXL2 (0.50) | L3MBTL1CYP19A1LOXLOXL2MAOA | |
| SCHEMBL9587491 | 0.78 | HTR6 (0.54) | L3MBTL1CYP19A1LOXLOXL2MAOA | |
| SCHEMBL30054430 | 0.76 | CYP1A2 (0.59) | MAPTALDH1A1IDO1KDM4ECYP3A4 | |
| SCHEMBL3934050 | 0.76 | HTR6 (0.61) | L3MBTL1POLBLOXLOXL2MAOA | |
| SCHEMBL1035887 | 0.76 | CYP1A2 (0.59) | MAPTALDH1A1IDO1KDM4ECYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993013079-A1 | ANTIFOLATE QUINAZOLINES | AGOURON PHARMACEUTICALS, INC. (US) | 1993-07-08 | — | — | WO | disclosed |