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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL94689 | 0.82 | — | — | |
| Water SCHEMBL29152719 | 0.82 | — | — | |
| Water SCHEMBL5482477 | 0.82 | — | — | |
| Water SCHEMBL2721099 | 0.82 | — | — | |
| Water SCHEMBL1323260 | 0.82 | — | — | |
| Methane SCHEMBL23273758 | 0.67 | — | — | |
| Water SCHEMBL11762302 | 0.67 | — | — | |
| Water SCHEMBL15200576 | 0.67 | — | — | |
| Water SCHEMBL1449717 | 0.67 | — | — | |
| Water SCHEMBL12987015 | 0.67 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1708297-A1 | Powdery material, electrode member, method for manufacturing same and secondary cell | CANON KABUSHIKI KAISHA (JP) | 2006-10-04 | — | — | EP | claimed |
| CN-1185732-C | Powder material, electrode member, method for producing the same, and secondary battery | CANON KK (JP) | 2005-01-19 | — | — | CN | claimed |
| CN-1529367-A | Powdered material, electrode components and their manufacturing method and secondary cells | ������������ʽ���� | 2004-09-15 | — | — | CN | claimed |
| US-6329101-B1 | HYDROGEN-STORING ALLOY COATED WITH A TRANSITION METAL OXIDE AND A TRANSITION METAL HAVING A FUNCTION OF ACTIVATING HYDROGEN DISPERSED ON THE OUTERMOST SURFACE, PREVENTING OXIDATION OF ALLOY AND ALLOWING HYDROGEN TO PASS THROUGH; | CANON KABUSHIKI KAISHA (JP) | 2001-12-11 | — | — | US | claimed |
| US-6040087-A | RESISTANCE TO OVERCHARGE, A HIGH CHARGING AND DISCHARGING EFFICIENCY AND A LONG CYCLE LIFE | CANON KABUSHIKI KAISHA (JP) | 2000-03-21 | — | — | US | claimed |
| CN-1197303-A | Powder material, electrode member, method for producing the same, and secondary battery | CANON KK (JP) | 1998-10-28 | — | — | CN | claimed |
| EP-0851515-A2 | Powdery material, electrode member, method for manufacturing same and secondary cell | CANON KABUSHIKI KAISHA (JP) | 1998-07-01 | — | — | EP | claimed |
| CN-1314149-C | Powdered material, electrode components and their manufacturing method and secondary cells | CANON KK (JP) | 2007-05-02 | — | — | CN | disclosed |
| EP-1708297-A1 | Powdery material, electrode member, method for manufacturing same and secondary cell | CANON KABUSHIKI KAISHA (JP) | 2006-10-04 | — | — | EP | disclosed |
| CN-1185732-C | Powder material, electrode member, method for producing the same, and secondary battery | CANON KK (JP) | 2005-01-19 | — | — | CN | disclosed |
| CN-1529367-A | Powdered material, electrode components and their manufacturing method and secondary cells | ������������ʽ���� | 2004-09-15 | — | — | CN | disclosed |
| US-6329101-B1 | HYDROGEN-STORING ALLOY COATED WITH A TRANSITION METAL OXIDE AND A TRANSITION METAL HAVING A FUNCTION OF ACTIVATING HYDROGEN DISPERSED ON THE OUTERMOST SURFACE, PREVENTING OXIDATION OF ALLOY AND ALLOWING HYDROGEN TO PASS THROUGH; | CANON KABUSHIKI KAISHA (JP) | 2001-12-11 | — | — | US | disclosed |
| US-6040087-A | RESISTANCE TO OVERCHARGE, A HIGH CHARGING AND DISCHARGING EFFICIENCY AND A LONG CYCLE LIFE | CANON KABUSHIKI KAISHA (JP) | 2000-03-21 | — | — | US | disclosed |
| CN-1197303-A | Powder material, electrode member, method for producing the same, and secondary battery | CANON KK (JP) | 1998-10-28 | — | — | CN | disclosed |
| EP-0851515-A2 | Powdery material, electrode member, method for manufacturing same and secondary cell | CANON KABUSHIKI KAISHA (JP) | 1998-07-01 | — | — | EP | disclosed |