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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.56 |
| ▸ | TSHR | P16473 | 5/20 | 0.56 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | ALPL | P05186 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.48 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
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 SCHEMBL8588305 | 1.00 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| Bromide SCHEMBL7106161 | 1.00 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL25302086 | 0.97 | ALDH1A1 (0.59) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL29350007 | 0.97 | ALDH1A1 (0.59) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL27953 | 0.97 | ALDH1A1 (0.59) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL6077039 | 0.94 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| Hydrochloric Acid SCHEMBL4268575 | 0.94 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL17836548 | 0.94 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL2638067 | 0.94 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| Phosphine SCHEMBL6665557 | 0.94 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113831628-A | Porous plum blossom pipe and preparation method thereof | 义博通信设备集团股份有限公司 | 2021-12-24 | — | — | CN | claimed |
| CN-111606946-A | Synthetic method of 2,2 '-bis-diphenylphosphino-1, 1' -binaphthyl | 严文忠 | 2020-09-01 | — | — | CN | claimed |
| JP-10130286-A | — | — | None | — | — | JP | disclosed |
| CN-113831628-A | Porous plum blossom pipe and preparation method thereof | 义博通信设备集团股份有限公司 | 2021-12-24 | — | — | CN | disclosed |
| CN-111606946-A | Synthetic method of 2,2 '-bis-diphenylphosphino-1, 1' -binaphthyl | 严文忠 | 2020-09-01 | — | — | CN | disclosed |
| CN-111606946-A | Synthetic method of 2,2 '-bis-diphenylphosphino-1, 1' -binaphthyl | 严文忠 | 2020-09-01 | — | — | CN | disclosed |
| JP-H10130286-A | NEW OPTICALLY ACTIVE DIPHOSPHINE, ITS DERIVED TRANSITION METAL COMPLEX, AND PRODUCTION OF OPTICALLY ACTIVE SUBSTANCE | TAKASAGO INTERNATL CORP | 1998-05-19 | — | — | JP | disclosed |