Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 7/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8346993 | 0.85 | ELANE (0.47) | MAPTSMN1; SMN2ELANEKMT2ARAB9A | |
| SCHEMBL8346992 | 0.85 | ELANE (0.47) | MAPTSMN1; SMN2ELANEKMT2ARAB9A | |
| SCHEMBL9857309 | 0.80 | MAPT (0.48) | RXFP1TP53MAPTTHRBSMN1; SMN2 | |
| SCHEMBL9857972 | 0.80 | SMN1; SMN2 (0.61) | TP53MAPTTHRBSMN1; SMN2NPC1 | |
| SCHEMBL10461391 | 0.80 | SMN1; SMN2 (0.61) | TP53MAPTTHRBSMN1; SMN2NPC1 | |
| SCHEMBL9803070 | 0.79 | ALOX5 (0.44) | TP53SMN1; SMN2ELANENPC1RAB9A | |
| SCHEMBL9802965 | 0.78 | ACACB (0.47) | MAPTKMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL9724876 | 0.77 | HSD17B10 (0.58) | MAPTELANEKMT2ALMNA | |
| SCHEMBL9724878 | 0.77 | HSD17B10 (0.58) | MAPTELANEKMT2ALMNA | |
| SCHEMBL9803470 | 0.76 | ACACB (0.49) | MAPTKMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5064569-A | Liquid crystals, chirally tilted, phenyl carboxylates | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-12 | — | — | US | disclosed |
| EP-0260275-A1 | OPTICALLY ACTIVE COMPOUNDS | MERCK PATENT GmbH (DE) | 1988-03-23 | — | — | EP | disclosed |
| WO-1987005017-A2 | OPTICALLY ACTIVE COMPOUNDS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1987-08-27 | — | — | WO | disclosed |