Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 7/20 | 0.47 |
| ▸ | THRB | P10828 | 7/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | TACR2 | P21452 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20039714 | 0.94 | THRA (0.55) | THRATHRBCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL18533188 | 0.88 | THRA (0.49) | THRATHRBCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL18722407 | 0.76 | NPC1 (0.42) | THRATHRBCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL23652017 | 0.72 | MEN1 (0.34) | CYP3A4CA1CA2ALDH1A1LMNA | |
| SCHEMBL10042898 | 0.71 | CA2 (0.59) | CYP3A4CYP2D6CYP2C9CA1CA2 | |
| SCHEMBL19034263 | 0.70 | CA1 (0.46) | THRATHRBCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL19724138 | 0.70 | THRB (0.44) | THRATHRBCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11887127 | 0.69 | CA2 (0.57) | CYP3A4CYP2D6CYP2C9CA1CA2 | |
| SCHEMBL27892539 | 0.69 | THRA (0.88) | THRATHRBMEN1KMT2APLA2G1B | |
| SCHEMBL83869 | 0.69 | CA2 (0.65) | THRATHRBCYP3A4CA1CA2 |
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-10301539-B2 | Polymer compound and light-emitting device using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2019-05-28 | — | — | US | disclosed |