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 | |
|---|---|---|---|---|
| ▸ | AXL | P30530 | 4/20 | 0.95 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.95 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | CDK8 | P49336 | 2/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | PRKCI | P41743 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL709685 | 0.98 | AXL (1.00) | AXLNUDT1MAPK1CDK8PIK3CD | |
| SCHEMBL17837 | 0.98 | — | — | |
| SCHEMBL29523425 | 0.98 | — | — | |
| SCHEMBL27753650 | 0.95 | AXL (0.95) | AXLNUDT1MAPK1CDK8PIK3CD | |
| Ammonia Solution, Strong SCHEMBL27486357 | 0.95 | AXL (0.95) | AXLNUDT1MAPK1CDK8PIK3CD | |
| Hydrochloric Acid SCHEMBL27893779 | 0.95 | AXL (0.95) | AXLNUDT1MAPK1CDK8PIK3CD | |
| SCHEMBL27692181 | 0.95 | — | — | |
| Methane SCHEMBL14738986 | 0.95 | AXL (0.95) | AXLNUDT1MAPK1CDK8PIK3CD | |
| Potassium SCHEMBL30760557 | 0.95 | AXL (0.95) | AXLNUDT1MAPK1CDK8PIK3CD | |
| SCHEMBL7639700 | 0.95 | AXL (0.95) | AXLNUDT1MAPK1CDK8PIK3CD |
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 |
|---|---|---|---|---|---|---|---|
| CN-1067892-A | The preparation method of new pyrrolo-[2,3-b] pyridine derivate | ASTRA AB (SE) | 1993-01-13 | — | — | CN | disclosed |