Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 6/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 5/20 | 0.32 |
| ▸ | HTR1D | P28221 | 5/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8767968 | 0.92 | NR5A1 (0.39) | NR5A1TSHRHTR1BTLR8MAPT | |
| SCHEMBL7522690 | 0.80 | HTR1B (0.38) | NR5A1TSHRHTR1BALDH2MAPT | |
| SCHEMBL8720472 | 0.79 | TLR8 (0.34) | TLR8MAPTKDM4ECYP1A2CYP2D6 | |
| SCHEMBL27491616 | 0.74 | CYP1A2 (0.44) | NR5A1TSHRMAPTTP53CYP1A2 | |
| SCHEMBL27491981 | 0.74 | CYP1A2 (0.44) | NR5A1TSHRMAPTTP53CYP1A2 | |
| SCHEMBL7879387 | 0.74 | CYP1A2 (0.44) | NR5A1TSHRMAPTTP53CYP1A2 | |
| SCHEMBL8904958 | 0.74 | CYP1A2 (0.44) | NR5A1TSHRMAPTTP53CYP1A2 | |
| SCHEMBL8930864 | 0.74 | THRA (0.43) | NR5A1TSHRHTR1BTP53 | |
| SCHEMBL8930849 | 0.74 | THRA (0.43) | NR5A1TSHRHTR1BTP53 | |
| SCHEMBL8724390 | 0.74 | THRA (0.43) | NR5A1TSHRHTR1BTP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5702638-A | FERROELECTRIC LIQUID CRYSTALS MIXTURES HAVING HIGH NEGATIVE VALUES FOR THE DIELECTRIC ANISOTROPY | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-12-30 | — | — | US | disclosed |
| EP-0743971-B1 | PHENANTHRIDINE DERIVATIVES AND THEIR USE IN LIQUID CRYSTAL MIXTURES | HOECHST AG (DE) | 1997-09-03 | — | — | EP | disclosed |
| EP-0743971-A1 | PHENANTHRIDINE DERIVATIVES AND THEIR USE IN LIQUID CRYSTAL MIXTURES | HOECHST AG (DE) | 1996-11-27 | — | — | EP | disclosed |
| WO-1995021227-A1 | PHENANTHRIDINE DERIVATIVES AND THEIR USE IN LIQUID CRYSTAL MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-08-10 | — | — | WO | disclosed |