Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.63 |
| ▸ | LMNA | P02545 | 3/20 | 0.63 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.63 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.63 |
| ▸ | TACR2 | P21452 | 2/20 | 0.63 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.63 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.63 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | SHBG | P04278 | 1/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.63 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.63 |
| ▸ | HTR2C | P28335 | 1/20 | 0.63 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.63 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.63 |
| ▸ | TST | Q16762 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL9578514 | 1.00 | ESR1 (0.63) | ESR1LMNAADRA2AADORA3TACR2 | |
| SCHEMBL10801643 | 1.00 | ESR1 (0.63) | ESR1LMNAADRA2AADORA3TACR2 | |
| SCHEMBL2433669 | 1.00 | ESR1 (0.63) | ESR1LMNAADRA2AADORA3TACR2 | |
| SCHEMBL2865085 | 0.99 | LMNA (0.60) | ESR1LMNAADRA2AADORA3TACR2 | |
| SCHEMBL28921724 | 0.99 | LMNA (0.60) | ESR1LMNAADRA2AADORA3TACR2 | |
| SCHEMBL9507965 | 0.96 | MAPT (0.60) | ESR1LMNAADRA2AADORA3TACR2 | |
| SCHEMBL11116193 | 0.94 | SMN1; SMN2 (0.58) | ESR1LMNAADRA2AADORA3TACR2 | |
| SCHEMBL9341873 | 0.94 | THRB (0.64) | LMNAALDH1A1CYP3A4THRBTHRA | |
| SCHEMBL8380722 | 0.94 | THRB (0.64) | LMNAALDH1A1CYP3A4THRBTHRA | |
| SCHEMBL9342490 | 0.94 | THRB (0.64) | LMNAALDH1A1CYP3A4THRBTHRA |
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 |
|---|---|---|---|---|---|---|---|
| US-5098599-A | Aromatic esters with sulfide groups as liquid crystals | MITSUBISHI RAYON COMPANY LTD. (JP) | 1992-03-24 | — | — | US | disclosed |
| EP-0354355-A1 | Optically active compound and liquid crystal composition | MITSUBISHI RAYON CO., LTD. (JP) | 1990-02-14 | — | — | EP | disclosed |