Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL11566008 | 0.78 | CES2 (0.62) | PTPN1CES2CES1KMT2APOLB | |
| SCHEMBL24446 | 0.78 | — | — | |
| SCHEMBL2405291 | 0.78 | — | — | |
| SCHEMBL3811314 | 0.78 | CES2 (0.68) | PTPN1CES2CES1KMT2APOLB | |
| SCHEMBL30911231 | 0.78 | CES2 (0.52) | PTPN1CES2CES1KMT2APOLB | |
| Acetone SCHEMBL28575425 | 0.77 | CES2 (0.60) | PTPN1CES2CES1KMT2APOLB | |
| SCHEMBL546936 | 0.77 | PTPN1 (0.39) | PTPN1CES2CES1KMT2APOLB | |
| SCHEMBL6129939 | 0.77 | CES2 (0.60) | PTPN1CES2CES1KMT2APOLB | |
| Acetic Acid SCHEMBL584512 | 0.77 | CES2 (0.60) | PTPN1CES2CES1KMT2APOLB | |
| Methylamine SCHEMBL27782227 | 0.77 | CES2 (0.60) | PTPN1CES2CES1KMT2APOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-8183398-B2 | 5-hydroxy-2-methyl-4H-pyran-4-one esters as novel tyrosinase inhibitors | EASTMAN CHEMICAL COMPANY (US) | 2012-05-22 | — | — | US | claimed |