Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | USP5 | P45974 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.30 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.30 |
| ▸ | PSEN2 | P49810 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9013765 | 1.00 | ESR2 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9512007 | 0.93 | HTR2A (0.37) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9511993 | 0.93 | HTR2A (0.37) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9250171 | 0.89 | USP5 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9349609 | 0.89 | USP5 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9979962 | 0.89 | USP5 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9349604 | 0.89 | USP5 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9349590 | 0.89 | USP5 (0.35) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9256820 | 0.86 | CCR2 (0.36) | ESR2CCR2HTR2AHTR2CHTR2B | |
| SCHEMBL9256824 | 0.86 | CCR2 (0.36) | ESR2CCR2HTR2AHTR2CHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0568040-B1 | Cyclohexane derivative and liquid crystal composition containing the same | CHISSO CORP (JP) | 1996-12-04 | — | — | EP | claimed |