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 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL277229 | 0.98 | ALDH1A1 (0.38) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL497000 | 0.95 | ALDH1A1 (0.37) | ALDH1A1 | |
| Iodide SCHEMBL27688320 | 0.95 | ALDH1A1 (0.37) | ALDH1A1 | |
| Bromide SCHEMBL798684 | 0.95 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL7048307 | 0.85 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL1046091 | 0.76 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL4617310 | 0.74 | ALDH1A1 (0.35) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7938586 | 0.73 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL1140010 | 0.69 | GAA (0.34) | ALDH1A1 | |
| SCHEMBL1140038 | 0.69 | ALDH1A1 (0.31) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1945693-B1 | POLYARYLATE-SILOXANE COPOLYMERS | MOMENTIVE PERFORMANCE MAT INC (US) | 2014-08-13 | — | — | EP | disclosed |
| EP-1957558-A2 | POLYARYLATE ACID CHLORIDE COMPOSITIONS AND DERIVATES THEREFROM | General Electric Company (US) | 2008-08-20 | — | — | EP | disclosed |
| EP-1945693-A1 | POLYARYLATE-SILOXANE COPOLYMERS | Momentive Performance Materials Inc. (US) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007070377-A2 | POLYARYLATE ACID CHLORIDE COMPOSITIONS AND DERIVATES THEREFROM | GENERAL ELECTRIC COMPANY (US) | 2007-06-21 | — | — | WO | disclosed |
| US-20070135610-A1 | Polyarylate acid chloride compositions and derivatives therefrom | GENERAL ELECTRIC COMPANY (US) | 2007-06-14 | — | — | US | disclosed |
| WO-2007047083-A1 | POLYARYLATE-SILOXANE COPOLYMERS | MOMENTIVE PERFORMANCE MATERIALS INC. (US) | 2007-04-26 | — | — | WO | disclosed |
| US-20070083026-A1 | Polyarylate-siloxane copolymers | GENERAL ELECTRIC COMPANY (US) | 2007-04-12 | — | — | US | disclosed |