Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 3/20 | 0.60 |
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | ACR | P10323 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL17301216 | 1.00 | THRB (0.60) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL17301203 | 0.99 | THRB (0.58) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL26478176 | 0.97 | THRB (0.60) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL17301201 | 0.97 | THRB (0.60) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL16674157 | 0.97 | THRB (0.55) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL12794252 | 0.97 | THRB (0.55) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL7620848 | 0.97 | THRB (0.55) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL14346695 | 0.97 | THRB (0.55) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL13220816 | 0.97 | THRB (0.55) | THRBHTTCYP3A4NPC1LMNA | |
| SCHEMBL450098 | 0.97 | THRB (0.55) | THRBHTTCYP3A4NPC1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0749466-B1 | NOVEL POLYMERISABLE LIQUID-CRYSTALLINE COMPOUNDS | BASF AG (DE) | 1997-11-12 | — | — | EP | disclosed |
| EP-0749466-A1 | NOVEL POLYMERISABLE LIQUID-CRYSTALLINE COMPOUNDS | BASF AKTIENGESELLSCHAFT (DE) | 1996-12-27 | — | — | EP | disclosed |
| WO-1995024454-A1 | NOVEL POLYMERISABLE LIQUID-CRYSTALLINE COMPOUNDS | BASF AKTIENGESELLSCHAFT (DE) | 1995-09-14 | — | — | WO | disclosed |