Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | PAM | P19021 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 7/20 | 0.44 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.44 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL8528187 | 1.00 | HTR2A (0.50) | HTR2AHIF1AIDO1PAMCHRNA7 | |
| Hydrochloric Acid SCHEMBL2452749 | 0.96 | HTR2A (0.50) | HTR2AHIF1AIDO1PAMCHRNA7 | |
| Hydrochloric Acid SCHEMBL2452746 | 0.96 | HTR2A (0.50) | HTR2AHIF1AIDO1PAMCHRNA7 | |
| Bromide SCHEMBL2449964 | 0.96 | HTR2A (0.50) | HTR2AHIF1AIDO1PAMCHRNA7 | |
| Bromide SCHEMBL2449961 | 0.96 | HTR2A (0.50) | HTR2AHIF1AIDO1PAMCHRNA7 | |
| SCHEMBL9178569 | 0.90 | HTR2A (0.46) | HTR2AHIF1AIDO1PAMCHRNA7 | |
| SCHEMBL9178576 | 0.90 | HTR2A (0.46) | HTR2AHIF1AIDO1PAMCHRNA7 | |
| Hydrochloric Acid SCHEMBL14839973 | 0.80 | HIF1A (0.55) | HTR2AHIF1ACHRNA7GRIK1GRIK2 | |
| Bromide SCHEMBL8925807 | 0.80 | HIF1A (0.55) | HTR2AHIF1ACHRNA7GRIK1GRIK2 | |
| Hydrochloric Acid SCHEMBL2447465 | 0.80 | HIF1A (0.55) | HTR2AHIF1ACHRNA7GRIK1GRIK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0673959-B1 | Process for producing aromatic polycarbonate | MITSUBISHI CHEM CORP (JP) | 1998-10-28 | — | — | EP | claimed |
| US-5527875-A | Process for producing aromatic polycarbonate | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-06-18 | — | — | US | claimed |
| EP-0673959-A1 | Process for producing aromatic polycarbonate | Mitsubishi Chemical Corporation (JP) | 1995-09-27 | — | — | EP | claimed |
| EP-0673959-B1 | Process for producing aromatic polycarbonate | MITSUBISHI CHEM CORP (JP) | 1998-10-28 | — | — | EP | disclosed |
| US-5527875-A | Process for producing aromatic polycarbonate | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-06-18 | — | — | US | disclosed |
| EP-0673959-A1 | Process for producing aromatic polycarbonate | Mitsubishi Chemical Corporation (JP) | 1995-09-27 | — | — | EP | disclosed |