Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | SI | P14410 | 1/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11583082 | 0.81 | CYP1A2 (0.42) | CYP1A2GAAMGAMSIMGAM2 | |
| Butane SCHEMBL5481709 | 0.80 | GAA (0.44) | CYP1A2GAAMGAMSIMGAM2 | |
| Butane SCHEMBL21219383 | 0.77 | ALDH1A1 (0.50) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL3618711 | 0.75 | GAA (0.48) | CYP1A2GAAMGAMSIMGAM2 | |
| Butane SCHEMBL21219398 | 0.74 | ALDH1A1 (0.46) | ALDH1A1TSHR | |
| Butane SCHEMBL21219375 | 0.74 | ALDH1A1 (0.46) | CYP1A2GAAMGAMSIMGAM2 | |
| Butane SCHEMBL4247130 | 0.74 | TSHR (0.31) | TSHR | |
| SCHEMBL1506864 | 0.74 | — | — | |
| SCHEMBL12227423 | 0.73 | CYP1A2 (0.42) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL11583081 | 0.73 | CYP1A2 (0.39) | CYP1A2GAAMGAMSIMGAM2 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4436899-A | REACTION OF ORGANIC PHOSPHONATE OR PHOSPHATE WITH TETRAVALENT METAL COMPOUND | OCCIDENTAL RESEARCH CORPORATION (US) | 1984-03-13 | — | — | US | disclosed |
| EP-0010366-B1 | SOLID ORGANOMETALLIC INORGANIC POLYMERS AND THEIR APPLICATION | OCCIDENTAL RESEARCH CORPORATION (US) | 1983-02-16 | — | — | EP | disclosed |
| EP-0010857-B1 | LAYERED OR AMORPHOUS ORGANOMETALLIC INORGANIC POLYMERS AND THEIR USE | OCCIDENTAL RESEARCH CORPORATION (US) | 1982-10-20 | — | — | EP | disclosed |
| US-4298723-A | ION EXCHANGERS, CATALYSTS, SORBENTS, CONTROLLED RELEASE, INTERCALATION COMPOUNDS | OCCIDENTAL RESEARCH CORPORATION (US) | 1981-11-03 | — | — | US | disclosed |
| US-4256872-A | INTERCALATION COMPOUNDS PREPARED BY THE METATHESIS REACTION IN LIQUID PHASE OF AN INORGANIC TETRAVALENT METAL COMPOUND AND AN ORGANIC PHOSPHONATE; ION EXCHANGERS | OCCIDENTAL RESEARCH CORPORATION (US) | 1981-03-17 | — | — | US | disclosed |
| US-4235990-A | CRYSTALS WHICH DISPLAY INTERCALATION ACTIVITY OR CAN BE AMORPHOUS | OCCIDENTAL RESEARCH CORPORATION (US) | 1980-11-25 | — | — | US | disclosed |
| US-4232146-A | Process for preparing layered organophosphorus inorganic polymers | OCCIDENTAL RESEARCH CORPORATION (US) | 1980-11-04 | — | — | US | disclosed |
| EP-0010857-A2 | Layered or amorphous organometallic inorganic polymers and their use | OCCIDENTAL RESEARCH CORPORATION (US) | 1980-05-14 | — | — | EP | disclosed |
| EP-0010366-A1 | Solid organometallic inorganic polymers and their application | OCCIDENTAL RESEARCH CORPORATION (US) | 1980-04-30 | — | — | EP | disclosed |
| WO-1980000703-A1 | SOLID ORGANOMETALLIC INORGANIC POLYMERS | OCCIDENTAL RES CORP (US) | 1980-04-17 | — | — | WO | disclosed |
| WO-1980000704-A1 | LAYERED OR AMORPHOUS ORGANOMETALLIC INORGANIC POLYMERS | OCCIDENTAL RES CORP (US) | 1980-04-17 | — | — | WO | disclosed |