Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TYR | P14679 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.30 |
| ▸ | HTR1D | P28221 | 1/20 | 0.30 |
| ▸ | HTR1B | P28222 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL16615379 | 0.86 | TSHR (0.48) | TSHRHSD17B2HCRTR2KIF11ALDH1A1 | |
| SCHEMBL18104293 | 0.84 | ALDH1A1 (0.37) | TSHRALDH1A1 | |
| SCHEMBL20143907 | 0.83 | TSHR (0.40) | TSHRHSD17B2HCRTR2ALDH1A1LMNA | |
| SCHEMBL20143912 | 0.81 | TSHR (0.35) | TSHRKIF11ALDH1A1HSD17B10LMNA | |
| SCHEMBL20143910 | 0.80 | TSHR (0.37) | TSHRHCRTR2KIF11ALDH1A1HSD17B10 | |
| SCHEMBL20143908 | 0.79 | TSHR (0.36) | TSHR | |
| SCHEMBL11984188 | 0.79 | TSHR (0.46) | TSHRHCRTR2KIF11ALDH1A1HSD17B10 | |
| SCHEMBL18104303 | 0.78 | TSHR (0.41) | TSHRHCRTR2ALDH1A1HSD17B10ADRA2A | |
| SCHEMBL14981042 | 0.78 | TSHR (0.58) | TSHRHSD17B2HCRTR2ALDH1A1HSD17B10 | |
| SCHEMBL19901698 | 0.78 | TSHR (0.46) | TSHRHSD17B2HCRTR2ALDH1A1HTR1D |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9972783-B2 | High energy triarylamine compounds for hole transport materials | E I DU PONT DE NEMOURS AND COMPANY (US) | 2018-05-15 | — | — | US | disclosed |