Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | LMNA | P02545 | 5/20 | 0.63 |
| ▸ | MAPT | P10636 | 5/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | HTT | P42858 | 2/20 | 0.63 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.63 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.63 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7516062 | 1.00 | ALDH1A1 (0.63) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| Acetic Acid SCHEMBL28747365 | 0.86 | ALDH1A1 (0.61) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| SCHEMBL600479 | 0.83 | ALDH1A1 (0.68) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| SCHEMBL600478 | 0.83 | ALDH1A1 (0.68) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| SCHEMBL9330897 | 0.83 | ALDH1A1 (0.68) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| Water SCHEMBL9776234 | 0.81 | ALDH1A1 (0.66) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| Water SCHEMBL9776229 | 0.81 | ALDH1A1 (0.66) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| SCHEMBL28747364 | 0.80 | ALDH1A1 (0.54) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| SCHEMBL7513675 | 0.80 | EPHX1 (0.45) | ALDH1A1LMNAMAPTNPSR1HPGD | |
| SCHEMBL7513683 | 0.80 | EPHX1 (0.45) | ALDH1A1LMNAMAPTNPSR1HPGD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-8196287-A | — | — | None | — | — | JP | disclosed |
| EP-0801057-B1 | PROCESS FOR PRODUCING OPTICALLY ACTIVE TRANS-VINYL SULFIDE ALCOHOLS | SUNTORY LTD (JP) | 2002-01-16 | — | — | EP | disclosed |
| US-6049009-A | REDUCING A TRANS-VINYLSULFIDE KETONE COMPOUND WITH BORANE REDUCING AGENT IN PRESENCE OF OPTICALLY ACTIVE OXAZABOROLIDINE COMPOUND AND A SULFIDE COMPOUND SELECTED FROM DIMETHYLSULFIDE, METHYLPHENYLSULFIDE, DIPHENYLSULFIDE, DI-N-BUTYLSULFIDE | SUNTORY LIMITED (JP) | 2000-04-11 | — | — | US | disclosed |
| EP-0801057-A1 | PROCESS FOR PRODUCING OPTICALLY ACTIVE TRANS-VINYL SULFIDE ALCOHOLS | SUNTORY LIMITED (JP) | 1997-10-15 | — | — | EP | disclosed |
| JP-H08196287-A | PRODUCTION OF 3-HYDROXY-1-PHENYLTHIO-1-BUTENE USING A MICROORGANISM | DAICEL CHEM IND LTD | 1996-08-06 | — | — | JP | disclosed |