Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 4/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19072585 | 1.00 | TSHR (0.35) | TSHRLMNACYP3A4GABRA1GABRG2 | |
| SCHEMBL11805968 | 0.83 | GRM5 (0.31) | GRM5GRM1 | |
| SCHEMBL31257847 | 0.81 | TSHR (0.41) | TSHRLMNACYP3A4GABRA1GABRG2 | |
| SCHEMBL28933991 | 0.73 | TSHR (0.36) | TSHRLMNACYP3A4GABRA1GABRG2 | |
| SCHEMBL23654698 | 0.72 | GRM5 (0.31) | GRM5GRM1 | |
| Ammonia Solution, Strong SCHEMBL27991894 | 0.71 | — | — | |
| SCHEMBL17351844 | 0.70 | CA1 (0.35) | TSHRLMNACYP3A4GABRA1GABRG2 | |
| SCHEMBL27769894 | 0.69 | TSHR (0.38) | TSHRLMNACYP3A4GABRA1GABRG2 | |
| SCHEMBL17319456 | 0.69 | INPP5A (0.38) | TSHRLMNACYP3A4GABRA1GABRG2 | |
| SCHEMBL11406214 | 0.67 | GRM5 (0.31) | GRM5GRM1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9496502-B2 | Organic ionic compounds, compositions and electronic devices | MERCK PATENT GMBH (DE) | 2016-11-15 | — | — | US | disclosed |
| US-9496502-B2 | Organic ionic compounds, compositions and electronic devices | MERCK PATENT GMBH (DE) | 2016-11-15 | — | — | US | disclosed |
| US-20140249606-A1 | ORGANIC IONIC COMPOUNDS, COMPOSITIONS AND ELECTRONIC DEVICES | MERCK PATENT GMBH PATENTS & SCIENTIFIC INFORMATION (DE) | 2014-09-04 | — | — | US | disclosed |
| US-20140249606-A1 | ORGANIC IONIC COMPOUNDS, COMPOSITIONS AND ELECTRONIC DEVICES | MERCK PATENT GMBH PATENTS & SCIENTIFIC INFORMATION (DE) | 2014-09-04 | — | — | US | disclosed |
| WO-2012152366-A1 | ORGANIC IONIC COMPOUNDS, COMPOSITIONS AND ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2012-11-15 | — | — | WO | disclosed |