Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA3 | P07451 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
| ▸ | CA6 | P23280 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL26421911 | 0.88 | PYCR1 (0.33) | — | |
| SCHEMBL18232142 | 0.88 | — | — | |
| SCHEMBL9771236 | 0.84 | — | — | |
| SCHEMBL23679747 | 0.80 | — | — | |
| Trimethylammonium SCHEMBL27876925 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL25554565 | 0.77 | — | — | |
| SCHEMBL368094 | 0.76 | ADRB2 (0.35) | ADRB2ADRB1 | |
| Trimethylammonium SCHEMBL7199365 | 0.75 | MAPT (0.32) | ADRB2ADRB1 | |
| Trimethylammonium SCHEMBL29196102 | 0.75 | KDM1A (0.33) | — | |
| SCHEMBL10643000 | 0.75 | KMT2A (0.43) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5200097-A | Atomization of a liquefied blend of a polyoxyethylene derivative and a bis(alkylamidoalkyl)amine-derived quaternary salt | SHEREX CHEMICAL COMPANY, INC. (US) | 1993-04-06 | — | — | US | disclosed |