Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.94 |
| ▸ | IDO1 | P14902 | 1/20 | 0.57 |
| ▸ | AGXT | P21549 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 5/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA9 | Q16790 | 3/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | TACR1 | P25103 | 2/20 | 0.48 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5311581 | 0.97 | TSHR (1.00) | TSHRIDO1AGXTCA1CA2 | |
| SCHEMBL27380 | 0.97 | TSHR (1.00) | TSHRIDO1AGXTCA1CA2 | |
| SCHEMBL1009266 | 0.94 | TSHR (0.94) | TSHRIDO1AGXTCA1CA2 | |
| SCHEMBL9795394 | 0.94 | TSHR (0.94) | TSHRIDO1AGXTCA1CA2 | |
| Barium SCHEMBL3798966 | 0.94 | TSHR (0.94) | TSHRIDO1AGXTCA1CA2 | |
| Methane SCHEMBL11192510 | 0.94 | TSHR (0.94) | TSHRIDO1AGXTCA1CA2 | |
| Potassium SCHEMBL586337 | 0.94 | TSHR (0.94) | TSHRIDO1AGXTCA1CA2 | |
| SCHEMBL10317949 | 0.94 | TSHR (0.94) | TSHRIDO1AGXTCA1CA2 | |
| Calcium SCHEMBL2864550 | 0.94 | TSHR (0.94) | TSHRIDO1AGXTCA1CA2 | |
| SCHEMBL9725547 | 0.94 | TSHR (0.94) | TSHRIDO1AGXTCA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0345861-B1 | ALKOXYLATION PROCESS CATALYZED BY COMPOUNDS OF THE RARE EARTH ELEMENTS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-01-20 | — | — | EP | disclosed |
| EP-0321053-B1 | ALKOXYLATION PROCESS USING CATALYSTS OF THE LANTHANUM SERIES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1992-08-26 | — | — | EP | disclosed |
| US-5059719-A | Using soluble, basic, organic rare earth compounds for the reaction of alkylene oxide adducts from an alkylene oxide and an active hydrogen-containing compound | SHELL OIL COMPANY (US) | 1991-10-22 | — | — | US | disclosed |
| US-5057628-A | Forming alkylene oxide adducts from vicinal alkylene oxides and active hydrogen containing compounds | SHELL OIL COMPANY (US) | 1991-10-15 | — | — | US | disclosed |
| EP-0345861-A1 | Alkoxylation process catalyzed by compounds of the rare earth elements | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-12-13 | — | — | EP | disclosed |
| EP-0321053-A1 | Alkoxylation process using catalysts of the lanthanum series | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-06-21 | — | — | EP | disclosed |