Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.39 |
| ▸ | KDM5A | P29375 | 2/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3911368 | 0.91 | CYP1A2 (0.50) | CYP1A2TSHRMAPTKMT2APOLB | |
| Methyl 2-Methylbutanoate SCHEMBL3915351 | 0.91 | TSHR (0.50) | TSHRMAPTCA1CA2POLB | |
| SCHEMBL26598404 | 0.85 | MAPT (0.54) | CYP1A2TSHRMAPTKMT2ACYP3A4 | |
| SCHEMBL22498473 | 0.84 | MAPT (0.57) | CYP1A2TSHRMAPTKMT2ACYP3A4 | |
| SCHEMBL30317638 | 0.84 | MAPT (0.57) | CYP1A2TSHRMAPTKMT2ACYP3A4 | |
| SCHEMBL1869381 | 0.84 | TSHR (0.43) | TSHRKMT2ACA1CA2POLB | |
| SCHEMBL1865676 | 0.83 | TSHR (0.45) | CYP1A2TSHRMAPTKMT2ACA1 | |
| SCHEMBL7636079 | 0.80 | TSHR (0.54) | CYP1A2TSHRMAPTCA2DGKA | |
| SCHEMBL27430679 | 0.80 | TSHR (0.54) | CYP1A2TSHRMAPTCA2DGKA | |
| SCHEMBL11892835 | 0.78 | TSHR (0.52) | CYP1A2TSHRMAPTKMT2ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-20040238785-A1 | Ester-containing fluid compositions | VAN DRIESSCHE EDDY (BE) | 2004-12-02 | — | — | US | disclosed |
| EP-1259471-A1 | ESTER-CONTAINING FLUID COMPOSITIONS | Exxonmobil Chemical Patents Inc. (US) | 2002-11-27 | — | — | EP | disclosed |
| US-20020005503-A1 | Ester-containing fluid compositions | EXXONMOBIL CHEMICAL PATENTS INC. | 2002-01-17 | — | — | US | disclosed |
| WO-2001047858-A1 | ESTER-CONTAINING FLUID COMPOSITIONS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2001-07-05 | — | — | WO | disclosed |