Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8915029 | 1.00 | HTT (0.43) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL8912528 | 1.00 | HTT (0.43) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL8913162 | 1.00 | HTT (0.43) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL8913978 | 1.00 | HTT (0.43) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL8914951 | 0.99 | HTT (0.42) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL12731853 | 0.99 | HTT (0.44) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL815840 | 0.99 | HTT (0.44) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL12731850 | 0.99 | HTT (0.44) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL8913538 | 0.98 | THRB (0.46) | HTTPTPN2PTPN1THRBNPC1 | |
| SCHEMBL8913742 | 0.98 | THRB (0.46) | HTTPTPN2PTPN1THRBNPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5593617-A | Photochemically polymerizable liquid crystals | HOFFMANN-LAROCHE INC. (US) | 1997-01-14 | — | — | US | disclosed |