Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.58 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.58 |
| ▸ | TACR2 | P21452 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | SHBG | P04278 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.58 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.58 |
| ▸ | HTR2C | P28335 | 1/20 | 0.58 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.58 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.58 |
| ▸ | TST | Q16762 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL4594421 | 1.00 | ESR1 (0.58) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL10479742 | 0.98 | ESR1 (0.56) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL10709069 | 0.98 | SLC6A2 (0.61) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL10479745 | 0.98 | ESR1 (0.56) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL10479732 | 0.97 | SLC6A2 (0.59) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL10479737 | 0.97 | SLC6A2 (0.59) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL30012004 | 0.95 | SLC6A2 (0.53) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL9061456 | 0.95 | SLC6A2 (0.53) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL9407055 | 0.95 | ESR1 (0.55) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A | |
| SCHEMBL9407048 | 0.95 | ESR1 (0.55) | ESR1SLC6A2SLC6A4SLC6A3ADRA2A |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1187802-B1 | LIQUID CRYSTAL COMPOUNDS | ROLIC AG (CH) | 2008-01-02 | — | — | EP | disclosed |
| US-6746729-B1 | COMPONENTS OF POLYMERIZABLE LIQUID CRYSTALLINE MIXTURES IN PRODUCTION OF ORIENTATED LIQUID CRYSTALLINE POLYMER NETWORKS | ROLIC AG (CH) | 2004-06-08 | — | — | US | disclosed |
| EP-1187802-A1 | LIQUID CRYSTAL COMPOUNDS | Rolic AG (CH) | 2002-03-20 | — | — | EP | disclosed |
| WO-2000063154-A1 | LIQUID CRYSTAL COMPOUNDS | ROLIC AG (CH) | 2000-10-26 | — | — | WO | disclosed |
| EP-1046631-A1 | Liquid crystalline compounds | Rolic AG (CH) | 2000-10-25 | — | — | EP | disclosed |
| EP-0247466-B1 | Liquid-crystal derivatives of phenyl benzoate | HOFFMANN LA ROCHE (CH) | 1993-11-24 | — | — | EP | disclosed |
| US-5082589-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1992-01-21 | — | — | US | disclosed |
| US-4925278-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1990-05-15 | — | — | US | disclosed |
| US-4830470-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1989-05-16 | — | — | US | disclosed |
| EP-0247466-A2 | Liquid-crystal derivatives of phenyl benzoate | F. HOFFMANN-LA ROCHE AG (CH) | 1987-12-02 | — | — | EP | disclosed |