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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 SCHEMBL11496054 | 1.00 | MEN1 (0.33) | MEN1ALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL11209337 | 0.98 | MEN1 (0.34) | MEN1ALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL11209340 | 0.98 | MEN1 (0.34) | MEN1ALDH1A1KMT2ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL11214486 | 0.97 | MEN1 (0.33) | MEN1ALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL8288374 | 0.59 | ALDH1A1 (0.54) | MEN1ALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL12948673 | 0.53 | — | — | |
| SCHEMBL11494719 | 0.53 | — | — | |
| SCHEMBL1708928 | 0.53 | — | — | |
| SCHEMBL5705022 | 0.52 | — | — | |
| SCHEMBL5705020 | 0.52 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0041246-B1 | 2-SUBSTITUTED-IMINO-3-ALKYL-TETRAHYDRO-6H-1,3,4-THIADIAZINE-5-ONES SALTS THEREOF AND THEIR PREPARATION | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1983-07-13 | — | — | EP | disclosed |
| EP-0018368-B1 | INSECTICIDAL 2-SUBSTITUTED-IMINO-3-ALKYL-5-DIALKOXYPHOSPHINOTHIOYLOXY-6H-1, 3,4-THIADIAZINES AND PREPARATION THEREOF | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1982-06-16 | — | — | EP | disclosed |
| EP-0041246-A2 | 2-Substituted-imino-3-alkyl-tetrahydro-6H-1,3,4-thiadiazine-5-ones salts thereof and their preparation | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1981-12-09 | — | — | EP | disclosed |
| EP-0018368-A1 | INSECTICIDAL 2-SUBSTITUTED-IMINO-3-ALKYL-5-DIALKOXYPHOSPHINOTHIOYLOXY-6H-1, 3,4-THIADIAZINES AND PREPARATION THEREOF. | CHEVRON RES (US) | 1980-11-12 | — | — | EP | disclosed |
| EP-0018368-A4 | INSECTICIDAL 2-SUBSTITUTED-IMINO-3-ALKYL-5-DIALKOXYPHOSPHINOTHIOYLOXY-6H-1, 3,4-THIADIAZINES AND PREPARATION THEREOF. | CHEVRON RES (US) | 1980-10-09 | — | — | EP | disclosed |
| WO-1979000829-A1 | INSECTICIDAL 2-SUBSTITUTED-IMINO-3-ALKYL-5-DIALKOXYPHOSPHINOTHIOLOXY-6H-1,3,4-THIADIAZINE,INTERMEDIATES THEREFOR AND PREPARATION THEREFOR | CHEVRON RES (US) | 1979-10-18 | — | — | WO | disclosed |
| US-4158732-A | Process for production of 2-substituted-imino-3-alkyl-tetrahydro-6H-1,3,4-thiadiazin-5-ones | CHEVRON RESEARCH COMPANY (US) | 1979-06-19 | — | — | US | disclosed |
| US-4144335-A | Insecticidal 2-substituted-imino-3-alkyl-5-dialkoxyphosphinothioyloxy-6H-1,3,4-thiadiazine | CHEVRON RESEARCH COMPANY (US) | 1979-03-13 | — | — | US | disclosed |