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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 7/20 | 0.96 |
| ▸ | CES1 | P23141 | 7/20 | 0.96 |
| ▸ | CA1 | P00915 | 2/20 | 0.63 |
| ▸ | CA2 | P00918 | 2/20 | 0.63 |
| ▸ | NPC1 | O15118 | 4/20 | 0.60 |
| ▸ | RAB9A | P51151 | 4/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.56 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL2156563 | 0.98 | CES2 (1.00) | CES2CES1CA1CA2NPC1 | |
| Hydrochloric Acid SCHEMBL905770 | 0.96 | CES2 (0.96) | CES2CES1CA1CA2NPC1 | |
| Benzoic Acid SCHEMBL29612332 | 0.92 | CES2 (0.89) | CES2CES1CA1CA2NPC1 | |
| Benzil SCHEMBL27611875 | 0.92 | CES2 (0.89) | CES2CES1CA1CA2NPC1 | |
| SCHEMBL557152 | 0.89 | CES2 (1.00) | CES2CES1CA1CA2RAB9A | |
| SCHEMBL14507040 | 0.89 | CES2 (1.00) | CES2CES1CA1CA2RAB9A | |
| SCHEMBL7560411 | 0.88 | CES2 (0.81) | CES2CES1CA1CA2NPC1 | |
| SCHEMBL8652128 | 0.88 | CES2 (0.81) | CES2CES1CA1CA2NPC1 | |
| SCHEMBL30504863 | 0.87 | CES2 (0.79) | CES2CES1CA1CA2NPC1 | |
| SCHEMBL29548151 | 0.87 | CES2 (0.95) | CES2CES1CA1CA2RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7871754-B2 | Photosensitive composition | KABUSHIKI KAISHA TOSHIBA (JP) | 2011-01-18 | — | — | US | disclosed |
| US-20090208866-A1 | PHOTOSENSITIVE COMPOSITION | TOSHIBA MEMORY CORPORATION (JP) | 2009-08-20 | — | — | US | disclosed |