Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 4/20 | 0.46 |
| ▸ | MMP13 | P45452 | 4/20 | 0.46 |
| ▸ | ADAM17 | P78536 | 4/20 | 0.46 |
| ▸ | MMP1 | P03956 | 4/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | PNLIP | P16233 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9405700 | 1.00 | RARB (0.49) | RARBMEN1CYP2D6HTTKMT2A | |
| SCHEMBL27457534 | 0.96 | HTT (0.52) | MEN1CYP2D6HTTKMT2ASLC6A2 | |
| SCHEMBL9440242 | 0.96 | HTT (0.52) | MEN1CYP2D6HTTKMT2ASLC6A2 | |
| Hydrochloric Acid SCHEMBL30725888 | 0.93 | HTT (0.56) | MEN1CYP2D6HTTKMT2ASLC6A2 | |
| SCHEMBL9325412 | 0.84 | KMT2A (0.48) | RARBMEN1CYP2D6KMT2ASLC6A2 | |
| SCHEMBL9324332 | 0.84 | HSD17B3 (0.51) | RARBMEN1CYP2D6KMT2ASLC6A2 | |
| SCHEMBL9717228 | 0.84 | NPC1 (0.51) | RARBMEN1HTTKMT2AMMP9 | |
| SCHEMBL9405582 | 0.84 | HSD17B3 (0.51) | RARBMEN1CYP2D6KMT2ASLC6A2 | |
| SCHEMBL9717247 | 0.84 | RARB (0.59) | RARBMEN1KMT2A | |
| SCHEMBL28718619 | 0.84 | SLC6A2 (0.58) | MEN1CYP2D6HTTKMT2ASLC6A2 |
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-0402110-B1 | Optical active compounds and liquid crystal compositions containing such compounds | WAKO PURE CHEM IND LTD (JP) | 1994-12-14 | — | — | EP | disclosed |
| US-5128062-A | OPTICALLY ACTIVE COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SUCH COMPOUNDS | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 1992-07-07 | — | — | US | disclosed |
| EP-0402110-A1 | Optical active compounds and liquid crystal compositions containing such compounds | WAKO PURE CHEMICAL INDUSTRIES LTD (JP) | 1990-12-12 | — | — | EP | disclosed |