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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16697215 | 0.83 | CA12 (0.38) | CA12CA2CA3CA4CA6 | |
| SCHEMBL29736046 | 0.80 | CA12 (0.36) | CA12CA2CA3CA4CA6 | |
| SCHEMBL15319486 | 0.77 | — | — | |
| SCHEMBL29060972 | 0.76 | CA12 (0.39) | CA12CA2CA3CA4CA6 | |
| SCHEMBL28988287 | 0.74 | SIGMAR1 (0.33) | CA12CA2CA3CA4CA6 | |
| SCHEMBL29109505 | 0.74 | GGT1 (0.33) | CA12CA2CA3CA4CA6 | |
| Alcohol SCHEMBL9008030 | 0.70 | LMNA (0.37) | — | |
| SCHEMBL13764626 | 0.69 | CA12 (0.38) | CA12CA2CA3CA4CA6 | |
| SCHEMBL19934807 | 0.69 | — | — | |
| SCHEMBL10998563 | 0.68 | DNM1 (0.41) | — |
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-0915648-A1 | METHODS AND COMPOSITIONS FOR THE SELECTIVE MODIFICATION OF NUCLEIC ACIDS | Pentose Pharmaceuticals, Inc. (US) | 1999-05-19 | — | — | EP | disclosed |
| EP-0915648-A4 | — | — | 1999-05-19 | — | — | EP | disclosed |
| WO-1997007674-A1 | METHODS AND COMPOSITIONS FOR THE SELECTIVE MODIFICATION OF NUCLEIC ACIDS | PENTOSE PHARMACEUTICALS, INC. (US) | 1997-03-06 | — | — | WO | disclosed |