Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 9/20 | 0.33 |
| ▸ | HTR2B | P41595 | 5/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CCND3 | P30281 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 6/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.30 |
| ▸ | HTR1A | P08908 | 2/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | DRD2 | P14416 | 2/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14767052 | 0.92 | TUBB1 (0.34) | TUBB1GABRA1GABRB2NAAA | |
| SCHEMBL14766508 | 0.92 | TUBB1 (0.42) | TUBB1NAAATNFRSF1A | |
| SCHEMBL14767032 | 0.90 | HTR2C (0.31) | HTR2CHTR2BHTR2A | |
| SCHEMBL14765821 | 0.90 | HTR2C (0.31) | HTR2CHTR2BHTR2A | |
| SCHEMBL12739427 | 0.90 | HTR2C (0.34) | TUBB1HTR2CHTR2BCHEK1CDK4 | |
| SCHEMBL14765958 | 0.87 | HTR2C (0.33) | TUBB1HTR2CHTR2BCHEK1CDK4 | |
| SCHEMBL14767031 | 0.87 | GABRA1 (0.35) | HTR2CHTR2BGABRA1GABRB2HTR2A | |
| SCHEMBL14766426 | 0.87 | GABRA1 (0.33) | TUBB1GABRA1GABRB2 | |
| SCHEMBL12718150 | 0.86 | HTR2C (0.32) | TUBB1HTR2CHTR2BCHEK1CDK4 | |
| SCHEMBL14766684 | 0.86 | GABRA1 (0.32) | TUBB1GABRA1GABRB2 |
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-8394294-B2 | Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2013-03-12 | — | — | US | disclosed |