Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | ZDHHC20 | Q5W0Z9 | 2/20 | 0.35 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7061519 | 0.98 | CA12 (0.43) | CA12CA1CA9CA2MGLL | |
| SCHEMBL7035443 | 0.92 | CA12 (0.41) | CA12CA1CA9CA2MGLL | |
| Hydrochloric Acid SCHEMBL14862018 | 0.92 | CA12 (0.44) | CA12CA1CA9CA2MGLL | |
| SCHEMBL1713038 | 0.86 | CA12 (0.41) | CA12CA1CA9CA2MGLL | |
| Hydrochloric Acid SCHEMBL1535756 | 0.84 | CA12 (0.40) | CA12CA1CA9CA2MGLL | |
| Bromide SCHEMBL6155069 | 0.84 | CA12 (0.40) | CA12CA1CA9CA2MGLL | |
| Fluoride Ion SCHEMBL5446663 | 0.84 | CA12 (0.40) | CA12CA1CA9CA2MGLL | |
| Iodide SCHEMBL7030478 | 0.84 | CA12 (0.40) | CA12CA1CA9CA2MGLL | |
| Hydrochloric Acid SCHEMBL25403550 | 0.83 | CA12 (0.39) | CA12CA1CA9CA2MGLL | |
| Hydrochloric Acid SCHEMBL6265698 | 0.83 | CA12 (0.39) | CA12CA1CA9CA2MGLL |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0819469-B1 | Quaternary bisphenolates as phase transfer catalysts | GEN ELECTRIC (US) | 2001-11-21 | — | — | EP | disclosed |
| US-5969086-A | CONTACTING ALKALI METAL SALT OF DIHYDROXYAROMATIC COMPOUND WITH HALO- OR NITRO-SUBSTITUTED AROMATIC COMPOUND IN PRESENCE OF CATALYTIC AMOUNT OF ALKALINE HYDROLYSIS PRODUCT OF QUATERNARY SALT OF DIHYDROXYAROMATIC COMPOUND | GENERAL ELECTRIC COMPANY (US) | 1999-10-19 | — | — | US | disclosed |
| US-5756843-A | REACTING DIHYDROXYAROMATIC COMPOUND, ALKALI METAL HYDROXIDE AND QUATERNARY SALT | GENERAL ELECTRIC COMPANY (US) | 1998-05-26 | — | — | US | disclosed |
| EP-0819469-A2 | Quaternary bisphenolates as phase transfer catalysts | GENERAL ELECTRIC COMPANY (US) | 1998-01-21 | — | — | EP | disclosed |