Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | METAP1 | P53582 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.34 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.33 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.33 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.33 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.33 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL284709 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL6263417 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL17156481 | 0.92 | — | — | |
| Fluoride SCHEMBL27138066 | 0.92 | — | — | |
| SCHEMBL18965368 | 0.87 | ALDH1A1 (0.40) | ALDH1A1METAP1OPRM1S1PR2S1PR1 | |
| SCHEMBL22047616 | 0.87 | ALDH1A1 (0.40) | ALDH1A1METAP1OPRM1S1PR2S1PR1 | |
| SCHEMBL18085359 | 0.87 | ALDH1A1 (0.40) | ALDH1A1METAP1OPRM1S1PR2S1PR1 | |
| SCHEMBL4198810 | 0.87 | OPRM1 (0.50) | ALDH1A1METAP1OPRM1TSHRTDP1 | |
| Dimethylamine SCHEMBL17156479 | 0.86 | ALDH1A1 (0.43) | ALDH1A1METAP1OPRM1S1PR2S1PR1 | |
| SCHEMBL25028298 | 0.85 | TSHR (0.43) | ALDH1A1METAP1OPRM1TSHRSPHK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102892713-B | There is the water of convertible ionic strength | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2016-05-04 | — | — | CN | claimed |
| CN-103459439-A | Systems and methods for use of water with switchable ionic strength | UNIV KINGSTON | 2013-12-18 | — | — | CN | claimed |
| CN-102892713-A | Water with switchable ionic strength | UNIV KINGSTON | 2013-01-23 | — | — | CN | claimed |
| CN-102892713-B | There is the water of convertible ionic strength | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2016-05-04 | — | — | CN | disclosed |
| CN-103459439-A | Systems and methods for use of water with switchable ionic strength | UNIV KINGSTON | 2013-12-18 | — | — | CN | disclosed |
| CN-102892713-A | Water with switchable ionic strength | UNIV KINGSTON | 2013-01-23 | — | — | CN | disclosed |