Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.69 |
| ▸ | ATM | Q13315 | 1/20 | 0.69 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | PRKCA | P17252 | 1/20 | 0.44 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.44 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.44 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | DGKA | P23743 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 0.42 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL420275 | 0.95 | CYP3A4 (0.75) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL3740679 | 0.93 | CYP3A4 (0.72) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL3749038 | 0.93 | CYP3A4 (0.72) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL418613 | 0.93 | CYP3A4 (0.72) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL3750378 | 0.93 | CYP3A4 (0.72) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL249038 | 0.93 | CYP3A4 (0.72) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL3742944 | 0.93 | CYP3A4 (0.72) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL3756095 | 0.92 | TSHR (0.61) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL3740920 | 0.91 | TSHR (0.62) | TSHRCYP3A4ATMTDP1LMNA | |
| SCHEMBL2344891 | 0.90 | CYP3A4 (0.79) | TSHRCYP3A4ATMTDP1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9079850-B2 | Cosmetic compositions containing esters of 2-ethylbutanol | COGNIS IP MANAGEMENT GMBH (DE) | 2015-07-14 | — | — | US | disclosed |
| US-20100292328-A1 | Cosmetic Compositions Containing Esters of 2-ethylbutanol | COGNIS IP MANAGEMENT GMBH (DE) | 2010-11-18 | — | — | US | disclosed |