Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | RHOA | P61586 | 1/20 | 0.32 |
| ▸ | LIG1 | P18858 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8663072 | 0.89 | MAPT (0.37) | MAPTCA1CA2CYP3A4NPSR1 | |
| SCHEMBL10442431 | 0.85 | MAPT (0.43) | MAPTCA1CA2CYP3A4GAA | |
| SCHEMBL10442717 | 0.85 | MAPT (0.43) | MAPTCA1CA2CYP3A4GAA | |
| SCHEMBL10429903 | 0.81 | CYP3A4 (0.38) | MAPTCA1CA2CYP3A4NPSR1 | |
| SCHEMBL10440660 | 0.81 | MAPT (0.38) | MAPTCA1CA2CYP3A4NPSR1 | |
| SCHEMBL10489544 | 0.79 | FABP7 (0.39) | MAPTCA1CA2MEN1LMNA | |
| SCHEMBL9487483 | 0.77 | TSHR (0.44) | CYP3A4ALDH1A1HSD17B10TSHRHTT | |
| SCHEMBL9487207 | 0.77 | TSHR (0.44) | CYP3A4ALDH1A1HSD17B10TSHRHTT | |
| SCHEMBL7941733 | 0.75 | MAPT (0.36) | MAPTCA1CA2MEN1KMT2A | |
| SCHEMBL4234394 | 0.75 | POLB (0.37) | MAPTCYP3A4KDM4EMEN1GAA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2059544-A | — | — | None | — | — | JP | disclosed |
| EP-0422996-A2 | Liquid crystal compound | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1991-04-17 | — | — | EP | disclosed |
| JP-H0259544-A | OPTICALLY ACTIVE COMPOUND AND ITS USE | NIPPON TELEGR & TELEPH CORP <NTT> | 1990-02-28 | — | — | JP | disclosed |
| US-4789751-A | Synthesis of new liquid crystal materials possessing phenylbenzoate or biphenyl core units and (2,3)-epoalkyloxirane methanol chiral tails | UNIVERSITY PATENTS, INC. (US) | 1988-12-06 | — | — | US | disclosed |
| US-4705874-A | Synthesis of new liquid crystal materials possessing phenylbenzoate or biphenyl core units and (2,3)-epoxyalkyloxiranemethanol chiral tails | UNIVERSITY PATENTS, INC. (US) | 1987-11-10 | — | — | US | disclosed |