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 | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | LGALS9 | O00182 | 1/20 | 0.45 |
| ▸ | LGALS1 | P09382 | 1/20 | 0.45 |
| ▸ | LGALS3 | P17931 | 1/20 | 0.45 |
| ▸ | LGALS7; LGALS7B | P47929 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | GAPDH | P04406 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
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 SCHEMBL6394977 | 1.00 | POLB (0.49) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL21894771 | 0.99 | POLB (0.50) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL16756804 | 0.99 | POLB (0.50) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL26906433 | 0.99 | POLB (0.50) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL15480819 | 0.99 | POLB (0.50) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL16769112 | 0.91 | PTPN1 (0.45) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL8357802 | 0.90 | TSHR (0.51) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL18490625 | 0.88 | POLB (0.47) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL2904043 | 0.87 | POLB (0.47) | POLBUSP2MEN1KMT2ALGALS9 | |
| SCHEMBL13211293 | 0.87 | POLB (0.47) | POLBUSP2MEN1KMT2ALGALS9 |
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 |
|---|---|---|---|---|---|---|---|
| US-7470784-B2 | Methods for synthesizing 2-chloro-9-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-9H-purin-6-amine | SOUTHERN RESEARCH INSTITUTE (US) | 2008-12-30 | — | — | US | claimed |