Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 10/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4475139 | 0.91 | MAPT (0.55) | ACACBALDH1A1LMNAMAPTHPGD | |
| SCHEMBL9509363 | 0.86 | ACACB (0.52) | ACACBALDH1A1LMNASMN1; SMN2MCHR1 | |
| SCHEMBL18431949 | 0.85 | KDM4E (0.56) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL14926643 | 0.85 | ACACB (0.50) | ACACBMCHR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL14231797 | 0.85 | KDM4E (0.56) | ACACBALDH1A1SMN1; SMN2MCHR1CHRNB2 | |
| SCHEMBL14926645 | 0.85 | ACACB (0.50) | ACACBMCHR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL9511456 | 0.84 | ACACB (0.58) | ACACBALDH1A1LMNAMAPTHPGD | |
| Ammonia Solution, Strong SCHEMBL23291230 | 0.84 | KDM4E (0.54) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| Ammonia Solution, Strong SCHEMBL23291311 | 0.84 | KDM4E (0.54) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL9509270 | 0.84 | CYP2A6 (0.44) | ACACBALDH1A1LMNAMAPTHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | claimed |
| EP-2727903-A1 | CINNAMIC ACID DERIVATIVE, POLYMER THEREOF, AND LIQUID CRYSTAL ALIGNMENT LAYER COMPRISING HARDENED PRODUCT OF SAID POLYMER | DIC Corporation (JP) | 2014-05-07 | — | — | EP | disclosed |
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |