Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | NMT1 | P30419 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | LNPEP | Q9UIQ6 | 7/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9189352 | 0.96 | S1PR3 (0.38) | S1PR3NMT1GAAMAPTHTT | |
| SCHEMBL9189219 | 0.90 | ALDH1A1 (0.39) | S1PR3NMT1GAAMAPTHTT | |
| SCHEMBL9239760 | 0.86 | S1PR3 (0.39) | S1PR3NMT1GAAMAPTHTT | |
| SCHEMBL9239762 | 0.86 | S1PR3 (0.39) | S1PR3NMT1GAAMAPTHTT | |
| SCHEMBL9324766 | 0.83 | NMT1 (0.43) | NMT1 | |
| SCHEMBL10652394 | 0.82 | S1PR3 (0.45) | S1PR3GAAMAPTHTT | |
| SCHEMBL451722 | 0.81 | S1PR3 (0.47) | S1PR3GAAMAPTHTT | |
| SCHEMBL8367731 | 0.81 | S1PR3 (0.47) | S1PR3GAAMAPTHTT | |
| SCHEMBL8764128 | 0.81 | S1PR3 (0.47) | S1PR3GAAMAPTHTT | |
| SCHEMBL8578052 | 0.81 | S1PR3 (0.47) | S1PR3GAAMAPTHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0423520-B1 | Liquid crystalline composition for the use in a twisted nematic cell | MERCK PATENT GMBH (DE) | 1995-08-02 | — | — | EP | disclosed |
| EP-0423520-A2 | Liquid crystalline composition for the use in a twisted nematic cell | MERCK PATENT GmbH (DE) | 1991-04-24 | — | — | EP | disclosed |