Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 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 | |
|---|---|---|---|---|
| SCHEMBL2933697 | 0.82 | GABRA1 (0.46) | GABRA1GABRB2ALDH1A1TSHRATM | |
| SCHEMBL15525344 | 0.75 | SKP2 (0.41) | NPSR1S1PR1 | |
| SCHEMBL28051884 | 0.75 | GABRA1 (0.46) | GABRA1GABRB2ALDH1A1TSHRATM | |
| SCHEMBL27775805 | 0.68 | METAP1 (0.41) | ALDH1A1TSHRATMNPSR1CYP1A2 | |
| SCHEMBL27520994 | 0.68 | GABRA1 (0.46) | GABRA1GABRB2ALDH1A1TSHRCYP1A2 | |
| SCHEMBL23570446 | 0.67 | GABRA1 (0.42) | GABRA1GABRB2TSHRCYP1A2CYP2C9 | |
| SCHEMBL2416692 | 0.66 | GABRA1 (0.44) | GABRA1GABRB2ALDH1A1TSHRCYP2C9 | |
| SCHEMBL10159746 | 0.66 | GABRA1 (0.63) | GABRA1GABRB2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL16245884 | 0.66 | GABRA1 (0.44) | GABRA1GABRB2ALDH1A1 | |
| SCHEMBL5018733 | 0.66 | GABRA1 (0.44) | GABRA1GABRB2TSHRNPSR1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2838929-A1 | POLYMERS CONTAINING SUBSTITUTED TRIARYLAMINE UNITS AND ELECTROLUMINESCENT DEVICES CONTAINING SAID POLYMERS | Merck Patent GmbH (DE) | 2015-02-25 | — | — | EP | disclosed |
| WO-2013156130-A1 | POLYMERS CONTAINING SUBSTITUTED TRIARYLAMINE UNITS AND ELECTROLUMINESCENT DEVICES CONTAINING SAID POLYMERS | MERCK PATENT GMBH (DE) | 2013-10-24 | — | — | WO | disclosed |