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.
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 SCHEMBL8990184 | 1.00 | ALDH1A1 (0.33) | — | |
| Bromide SCHEMBL29258539 | 1.00 | — | — | |
| SCHEMBL229715 | 0.95 | ALDH1A1 (0.35) | — | |
| SCHEMBL19621 | 0.95 | — | — | |
| SCHEMBL31588091 | 0.91 | — | — | |
| SCHEMBL9650455 | 0.91 | — | — | |
| SCHEMBL31172630 | 0.91 | — | — | |
| SCHEMBL2277021 | 0.91 | — | — | |
| SCHEMBL7650639 | 0.91 | ALDH1A1 (0.33) | — | |
| SCHEMBL30874790 | 0.91 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101016226-B | Synthetic method and refining for dibromoneopentyl glycol | YIXING ZHONGZHENG CHEMICAL CO LTD | 2010-09-01 | — | — | CN | disclosed |
| CN-101016226-A | Synthetic method and refining for dibromoneopentyl glycol | YIXING ZHONGZHENG CHEMICAL CO (CN) | 2007-08-15 | — | — | CN | disclosed |
| US-5523424-A | REACTING A 3,3-BIS(TOSYL-, MESYLYL- OR HALOMETHYL)OXETANE AND A METAL AZIDE IN AN AQUEOUS SOLUTION CONTAINING A PHASE TRANSFER CATALYST | AEROJET-GENERAL CORPORATION (US) | 1996-06-04 | — | — | US | disclosed |
| US-5489700-A | USED IN CREATING ENERGETIC POLYETHER BINDERS | AEROJET-GENERAL CORPORATION (US) | 1996-02-06 | — | — | US | disclosed |
| US-5463019-A | Amorphous, high energy polyether that is curable to an elastomeric polyetherurethane binder in propellants; miscible with plasticizers | AEROJET-GENERAL CORPORATION (US) | 1995-10-31 | — | — | US | disclosed |
| WO-1994005615-A1 | 3-AZIDOMETHYL-3-NITRATOMETHYLOXETANE AND POLYMERS FORMED THEREFROM | AEROJET-GENERAL CORPORATION (US) | 1994-03-17 | — | — | WO | disclosed |