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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 2/20 | 0.30 |
| ▸ | CA1 | P00915 | 2/20 | 0.30 |
| ▸ | CA2 | P00918 | 2/20 | 0.30 |
| ▸ | CA9 | Q16790 | 2/20 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL797459 | 0.82 | — | — | |
| SCHEMBL8072255 | 0.81 | MAPT (0.36) | PTPN1CA12CA1CA2CA9 | |
| SCHEMBL28890052 | 0.76 | ALDH1A1 (0.34) | PTPN1CA12CA1CA2CA9 | |
| SCHEMBL17952999 | 0.74 | ALDH1A1 (0.37) | PTPN1CA12CA1CA2CA9 | |
| SCHEMBL5860453 | 0.74 | ALDH1A1 (0.37) | PTPN1CA12CA1CA2CA9 | |
| SCHEMBL30229819 | 0.74 | ALDH1A1 (0.37) | PTPN1CA12CA1CA2CA9 | |
| SCHEMBL7252936 | 0.73 | ALDH1A1 (0.36) | PTPN1CA12CA1CA2CA9 | |
| SCHEMBL28529430 | 0.73 | ALDH1A1 (0.36) | PTPN1CA12CA1CA2CA9 | |
| SCHEMBL7996888 | 0.73 | ALDH1A1 (0.36) | PTPN1CA12CA1CA2CA9 | |
| SCHEMBL28012310 | 0.73 | ALDH1A1 (0.36) | PTPN1CA12CA1CA2CA9 |
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-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | claimed |
| US-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | disclosed |