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 | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SNCA | P37840 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1673261 | 0.98 | IDO1 (0.40) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL28278551 | 0.75 | MAPT (0.43) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL5337764 | 0.74 | KMT2A (0.40) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL31589753 | 0.73 | ALDH1A1 (0.41) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL9389041 | 0.71 | PTPN1 (0.36) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL12629098 | 0.71 | HSPA1A (0.54) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL1881635 | 0.71 | EGFR (0.36) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL19054751 | 0.71 | IDO1 (0.33) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL24137942 | 0.70 | NLRP3 (0.36) | IDO1MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL11443711 | 0.69 | IDO1 (0.33) | IDO1MEN1KMT2AGAAALDH1A1 |
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-1189576-A2 | HAIR COMPOSITION COMPRISING AN OXIDASE AND CYCLODEXTRIN | Lion Corporation (JP) | 2002-03-27 | — | — | EP | disclosed |
| WO-2001000144-A2 | HAIR COMPOSITION COMPRISING AN OXIDASE AND CYCLODEXTRIN | LION CORPORATION (JP) | 2001-01-04 | — | — | WO | disclosed |
| CN-1047592-C | Tinctorial composition of 5,6-dihydroxyindole and dyeing method of keratose fibre | OREAL (FR) | 1999-12-22 | — | — | CN | disclosed |