Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15063824 | 0.82 | DGAT1 (0.33) | CYP2D6DGAT1HDAC3HDAC1HDAC2 | |
| SCHEMBL64420 | 0.80 | CYP2D6 (0.33) | CYP2D6DGAT1HDAC3HDAC1HDAC2 | |
| SCHEMBL19743162 | 0.78 | MAOA (0.32) | CYP2D6DGAT1HDAC3HDAC1HDAC2 | |
| SCHEMBL6351731 | 0.77 | TDP1 (0.42) | CYP2D6DGAT1HDAC3HDAC1HDAC2 | |
| SCHEMBL2150574 | 0.77 | TDP1 (0.32) | CYP2D6DGAT1HDAC3HDAC1HDAC2 | |
| SCHEMBL10339934 | 0.77 | DGAT1 (0.36) | CYP2D6DGAT1HDAC3HDAC1HDAC2 | |
| SCHEMBL12227460 | 0.76 | — | — | |
| SCHEMBL4931 | 0.75 | — | — | |
| SCHEMBL8813842 | 0.75 | — | — | |
| SCHEMBL21169172 | 0.74 | CYP2D6 (0.32) | CYP2D6DGAT1HDAC3HDAC1HDAC2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3128394-A | — | — | None | — | — | JP | disclosed |
| JP-H03128394-A | PEPTIDE INHIBITOR OF HUMAN PAPILLOMA VIRUS PROTEIN BINDING TO RETINOBLASTOMA GENE PROTEIN | MERCK & CO INC | 1991-05-31 | — | — | JP | disclosed |