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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 4/20 | 0.41 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.35 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.31 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | GPR183 | P32249 | 1/20 | 0.31 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3643521 | 0.97 | FDPS (0.42) | FDPSDNM1SMPD1TSHRLMNA | |
| SCHEMBL516377 | 0.97 | FDPS (0.42) | FDPSDNM1SMPD1TSHRLMNA | |
| Hydrochloric Acid SCHEMBL9784204 | 0.94 | FDPS (0.41) | FDPSDNM1SMPD1TSHRLMNA | |
| Ammonia Solution, Strong SCHEMBL29125155 | 0.94 | FDPS (0.41) | FDPSDNM1SMPD1TSHRLMNA | |
| Water SCHEMBL3485636 | 0.94 | FDPS (0.41) | FDPSDNM1SMPD1TSHRLMNA | |
| Ammonia Solution, Strong SCHEMBL23174674 | 0.94 | FDPS (0.41) | FDPSDNM1SMPD1TSHRLMNA | |
| Bromide SCHEMBL309594 | 0.94 | FDPS (0.44) | FDPSDNM1SMPD1TSHRLMNA | |
| Bromide SCHEMBL28899494 | 0.92 | FDPS (0.43) | FDPSDNM1SMPD1TSHRTHRB | |
| SCHEMBL93609 | 0.91 | FDPS (0.46) | FDPSDNM1SMPD1TSHRLMNA | |
| SCHEMBL9628080 | 0.88 | FDPS (0.44) | FDPSDNM1SMPD1TSHRTHRB |
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 |
|---|---|---|---|---|---|---|---|
| US-7576063-B2 | Pyrazole derivative, medicinal composition containing the same, medicinal use thereof and intermediate in producing the same | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-08-18 | — | — | US | disclosed |
| EP-1550668-A1 | PYRAZOLE DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF AND INTERMEDIATE IN PRODUCING THE SAME | Kissei Pharmaceutical Co., Ltd. (JP) | 2005-07-06 | — | — | EP | disclosed |