Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HTR1B | P28222 | 6/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 5/20 | 0.36 |
| ▸ | HTR1D | P28221 | 5/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8767604 | 0.92 | NR5A1 (0.34) | NR5A1TSHRHTR1BTLR8HTR1A | |
| SCHEMBL27491616 | 0.81 | CYP1A2 (0.44) | NR5A1TSHRTP53CYP1A2CYP3A4 | |
| SCHEMBL27491981 | 0.81 | CYP1A2 (0.44) | NR5A1TSHRTP53CYP1A2CYP3A4 | |
| SCHEMBL8904958 | 0.81 | CYP1A2 (0.44) | NR5A1TSHRTP53CYP1A2CYP3A4 | |
| SCHEMBL7879387 | 0.81 | CYP1A2 (0.44) | NR5A1TSHRTP53CYP1A2CYP3A4 | |
| SCHEMBL8720756 | 0.81 | THRA (0.43) | NR5A1TSHRHTR1BTP53 | |
| SCHEMBL8720777 | 0.81 | THRA (0.43) | NR5A1TSHRHTR1BTP53 | |
| SCHEMBL8724390 | 0.81 | THRA (0.43) | NR5A1TSHRHTR1BTP53 | |
| SCHEMBL8930849 | 0.81 | THRA (0.43) | NR5A1TSHRHTR1BTP53 | |
| SCHEMBL8930864 | 0.81 | 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 |