Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 8/20 | 0.35 |
| ▸ | CA2 | P00918 | 6/20 | 0.35 |
| ▸ | CA12 | O43570 | 5/20 | 0.35 |
| ▸ | CA9 | Q16790 | 5/20 | 0.35 |
| ▸ | CA7 | P43166 | 3/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10526715 | 0.94 | — | — | |
| Potassium Ion SCHEMBL6360383 | 0.94 | — | — | |
| Tetramethylammonium Ion SCHEMBL10643396 | 0.88 | TSHR (0.46) | TSHRHCAR2CA1CA2CA12 | |
| SCHEMBL6726187 | 0.86 | TSHR (0.43) | TSHRHCAR2CA1CA2CA12 | |
| SCHEMBL5704223 | 0.71 | — | — | |
| Bicarbonate SCHEMBL3706559 | 0.71 | TSHR (0.78) | TSHRHCAR2CA1CA2CA12 | |
| SCHEMBL297916 | 0.69 | TSHR (0.59) | TSHRHCAR2CA1CA2CA12 | |
| SCHEMBL36670 | 0.69 | TSHR (0.59) | TSHRHCAR2CA1CA2CA12 | |
| SCHEMBL23089358 | 0.67 | — | — | |
| SCHEMBL6726188 | 0.67 | TSHR (0.56) | TSHRHCAR2CA1CA2CA12 |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1991431-B1 | TIRE MADE OF A CROSSLINKED ELASTOMERIC COMPOSITION | PIRELLI (IT) | 2010-07-21 | — | — | EP | claimed |
| US-20090199945-A1 | Tire and Crosslinkable Elastomeric Composition | POLITECNICO DI MILANO (50%) (IT) | 2009-08-13 | — | — | US | claimed |
| EP-2626464-B1 | Composition for paper deacidification, process to obtain it and method for its application | INST NAT DE CERCETARE DEZVOLTARE PENTRU CHIMIE SI PETROCHIMIE - ICECHIM (RO) | 2017-03-22 | — | — | EP | disclosed |
| EP-1991431-B1 | TIRE MADE OF A CROSSLINKED ELASTOMERIC COMPOSITION | PIRELLI (IT) | 2010-07-21 | — | — | EP | disclosed |
| US-20090199945-A1 | Tire and Crosslinkable Elastomeric Composition | POLITECNICO DI MILANO (50%) (IT) | 2009-08-13 | — | — | US | disclosed |
| EP-1991431-A1 | TIRE AND CROSSLINKABLE ELASTOMERIC COMPOSITION | PIRELLI TYRE S.p.A. (IT) | 2008-11-19 | — | — | EP | disclosed |
| WO-2007098784-A1 | TIRE AND CROSSLINKABLE ELASTOMERIC COMPOSITION | PIRELLI TYRE S.P.A. (IT) | 2007-09-07 | — | — | WO | disclosed |
| US-20050044778-A1 | Fuel compositions employing catalyst combustion structure | OCTANE INTERNATIONAL, LTD. | 2005-03-03 | — | — | US | disclosed |
| EP-1051461-A2 | FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE | ORR, William C. (US) | 2000-11-15 | — | — | EP | disclosed |
| WO-1999066009-A2 | FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE | ORR WILLIAM C (US) | 1999-12-23 | — | — | WO | disclosed |
| US-4860685-A | Treatment of cellulosic materials | SMITH RICHARD D (US) | 1989-08-29 | — | — | US | disclosed |
| EP-0230455-A4 | TREATMENT OF CELLULOSIC MATERIALS. | SMITH RICHARD DANIEL | 1987-11-12 | — | — | EP | disclosed |
| EP-0230455-A1 | TREATMENT OF CELLULOSIC MATERIALS | SMITH, Richard Daniel (US) | 1987-08-05 | — | — | EP | disclosed |
| WO-1987000217-A1 | TREATMENT OF CELLULOSIC MATERIALS | SMITH RICHARD DANIEL | 1987-01-15 | — | — | WO | disclosed |