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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL11049750 | 0.87 | — | — | |
| Bromide SCHEMBL28090127 | 0.87 | — | — | |
| Bromide SCHEMBL11569553 | 0.87 | — | — | |
| Bromide SCHEMBL9936028 | 0.87 | — | — | |
| Bromide SCHEMBL29235136 | 0.87 | — | — | |
| Bromide SCHEMBL7172901 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL21222715 | 0.82 | — | — | |
| Bromide SCHEMBL10457047 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL20955920 | 0.82 | CA4 (0.50) | — | |
| Hydrochloric Acid SCHEMBL22288243 | 0.82 | — | — |
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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108329385-A | A kind of preparation method of regenerated silk fibroin solution | 苏州先蚕丝绸有限公司 | 2018-07-27 | — | — | CN | claimed |
| CN-114149324-B | Synthesis method of 6-hydroxy-8-chlorooctanoic acid ethyl ester, 6, 8-dichloro octanoic acid ethyl ester and lipoic acid | 厦门金达威维生素有限公司 | 2023-08-22 | — | — | CN | disclosed |
| CN-114149324-B | Synthesis method of 6-hydroxy-8-chlorooctanoic acid ethyl ester, 6, 8-dichloro octanoic acid ethyl ester and lipoic acid | 厦门金达威维生素有限公司 | 2023-08-22 | — | — | CN | disclosed |
| EP-4126825-A1 | AMINOCYCLOBUTANES AS MONOACYLGLYCEROL LIPASE MODULATORS | Janssen Pharmaceutica NV (BE) | 2023-02-08 | — | — | EP | disclosed |
| CN-114573438-A | Mono-fluorine chlorine/bromoacetone compound and preparation method thereof | 上海应用技术大学 | 2022-06-03 | — | — | CN | disclosed |
| CN-114149324-A | Synthesis method of 6-hydroxy-8-chloro ethyl caprylate, 6, 8-dichloro ethyl caprylate and lipoic acid | 厦门金达威维生素有限公司 | 2022-03-08 | — | — | CN | disclosed |
| CN-114149324-A | Synthesis method of 6-hydroxy-8-chloro ethyl caprylate, 6, 8-dichloro ethyl caprylate and lipoic acid | 厦门金达威维生素有限公司 | 2022-03-08 | — | — | CN | disclosed |
| US-11192875-B2 | Processes for preparing antiviral compounds | GILEAD PHARMASSET LLC (US) | 2021-12-07 | — | — | US | disclosed |
| WO-2021191391-A1 | AMINOCYCLOBUTANES AS MONOACYLGLYCEROL LIPASE MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2021-09-30 | — | — | WO | disclosed |
| US-20200392100-A1 | PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. | 2020-12-17 | — | — | US | disclosed |
| CN-101226018-A | Nano filter absorption refrigeration method and apparatus | MINGJIAN SUN (CN) | 2008-07-23 | — | — | CN | disclosed |
| CN-1102830-C | Ionene polymer tablets | BUCKMAN LABOR INC (US) | 2003-03-12 | — | — | CN | disclosed |
| US-6100222-A | COMPRISING WATER, A POLYMER, E.G. XANTHAN GUM, AND A MIXTURE OF SALTS OF GROUPS 1A, 2A AND ZINC; AGING/HEAT RESISTANCE, MECHANICAL AGITATION AND SHEAR; DRILLING, DRILL-IN, COMPLETION, HYDRAULIC FRACTURING, WORK-OVER, PACKER, WELLS | GREAT LAKES CHEMICAL CORPORATION (US) | 2000-08-08 | — | — | US | disclosed |
| EP-0871359-B1 | TABLETIZED IONENE POLYMERS | BUCKMAN LABOR INC (US) | 2000-01-12 | — | — | EP | disclosed |
| EP-0871359-A1 | TABLETIZED IONENE POLYMERS | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1998-10-21 | — | — | EP | disclosed |
| CN-1192649-A | Tabletized ionene polymers | BUCKMAN LABOR INC (US) | 1998-09-09 | — | — | CN | disclosed |
| US-5709880-A | Method of making tabletized ionene polymers | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1998-01-20 | — | — | US | disclosed |
| US-5707534-A | ANTIFOULING AGENTS FOR WATER AND BACTERICIDES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1998-01-13 | — | — | US | disclosed |
| US-5637308-A | WATER TREATMENT | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1997-06-10 | — | — | US | disclosed |
| WO-1997002744-A1 | TABLETIZED IONENE POLYMERS | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1997-01-30 | — | — | WO | disclosed |