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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GFER | P55789 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 SCHEMBL1797567 | 1.00 | KDM1A (0.39) | KDM1APOLBNOTUMMAOANPSR1 | |
| SCHEMBL3795637 | 0.98 | KDM1A (0.40) | KDM1APOLBNOTUMMAOANPSR1 | |
| Ammonia Solution, Strong SCHEMBL29105388 | 0.96 | KDM1A (0.39) | KDM1APOLBNOTUMMAOANPSR1 | |
| Iodide SCHEMBL3292671 | 0.96 | KDM1A (0.39) | KDM1APOLBNOTUMMAOANPSR1 | |
| Hydrochloric Acid SCHEMBL3937688 | 0.96 | KDM1A (0.39) | KDM1APOLBNOTUMMAOANPSR1 | |
| Iodide SCHEMBL28361954 | 0.96 | KDM1A (0.39) | KDM1APOLBNOTUMMAOANPSR1 | |
| Sulfuric Acid SCHEMBL6232322 | 0.88 | POLB (0.40) | POLBNOTUMNPSR1TP53HSD17B3 | |
| Perchlorate SCHEMBL30120605 | 0.88 | POLB (0.37) | KDM1APOLBNOTUMNPSR1TP53 | |
| Sulfuric Acid SCHEMBL7586602 | 0.87 | POLB (0.39) | POLBNOTUMNPSR1TP53HSD17B3 | |
| SCHEMBL27790361 | 0.83 | ALDH1A1 (0.44) | KDM1APOLBNOTUMMAOANPSR1 |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106478366-A | A kind of preparation method of 1,2- pentanediol | 衡阳春天医药化工设备有限公司 | 2017-03-08 | — | — | CN | claimed |
| CN-120025293-A | Difunctional aza-carbene catalyst and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2025-05-23 | — | — | CN | disclosed |
| CN-112442038-B | Industrial preparation method of pemetrexed disodium | 德州德药制药有限公司 | 2022-09-02 | — | — | CN | disclosed |
| CN-112174970-B | Method for preparing pemetrexed disodium with high yield | 德州德药制药有限公司 | 2022-06-07 | — | — | CN | disclosed |
| CN-109704921-B | Economic and green preparation method of vicinal dihydric alcohol | 淄博诺奥化工有限公司 | 2022-01-04 | — | — | CN | disclosed |
| CN-112442038-A | Industrial preparation method of pemetrexed disodium | 德州德药制药有限公司 | 2021-03-05 | — | — | CN | disclosed |
| CN-112174970-A | Method for preparing pemetrexed disodium in high yield | 德州德药制药有限公司 | 2021-01-05 | — | — | CN | disclosed |
| CN-109704921-A | The economical and eco-friendly preparation method of adjacent dihydric alcohol | 淄博诺奥化工股份有限公司 | 2019-05-03 | — | — | CN | disclosed |
| CN-106478366-A | A kind of preparation method of 1,2- pentanediol | 衡阳春天医药化工设备有限公司 | 2017-03-08 | — | — | CN | disclosed |
| CN-106478366-A | A kind of preparation method of 1,2- pentanediol | 衡阳春天医药化工设备有限公司 | 2017-03-08 | — | — | CN | disclosed |
| CN-102911176-B | Preparation method of pemetrexed disodium | DEZHOU DEYAO PHARMACEUTICAL CO LTD | 2015-07-22 | — | — | CN | disclosed |
| CN-103301881-B | Preparation method of crosslinked polystyrene-immobilized benzothiazole catalyst used for formose reaction | UNIV SHANDONG SCIENCE & TECH | 2014-11-05 | — | — | CN | disclosed |
| CN-103301881-A | Preparation method of crosslinked polystyrene-immobilized benzothiazole catalyst used for formose reaction | UNIV SHANDONG SCIENCE & TECH | 2013-09-18 | — | — | CN | disclosed |
| CN-101489998-B | Process for producing 2-hydroxy-4- (methylthio) butanoic acid or butyrate compound and intermediate thereof | SUMITOMO CO LTD | 2013-01-02 | — | — | CN | disclosed |
| CN-101489998-A | Process for producing 2-hydroxy-4- (methylthio) butanoic acid or butyrate compound and intermediate thereof | SUMITOMO CHEMICAL CO (JP) | 2009-07-22 | — | — | CN | disclosed |
| WO-2008104875-A1 | OXAZOLIDINONES AS CHOLESTEROL ABSORPTION INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-09-04 | — | — | WO | disclosed |