Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 11/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 11/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 11/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 11/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 11/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 10/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 10/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 10/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 10/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 10/20 | 0.50 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.46 |
| ▸ | NCOR2 | Q9Y618 | 3/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.41 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28014600 | 0.87 | HDAC6 (0.59) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL5333233 | 0.79 | HDAC3 (0.55) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28035847 | 0.77 | SMPD1 (0.67) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL11393727 | 0.76 | HSD17B10 (0.50) | KDM4EALDH1A1 | |
| SCHEMBL25229993 | 0.75 | SMN1; SMN2 (0.57) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28013853 | 0.74 | HDAC6 (0.60) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28013855 | 0.73 | HDAC6 (0.59) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL27727992 | 0.73 | CNR2 (0.49) | ALDH1A1 | |
| SCHEMBL28136805 | 0.72 | HDAC6 (0.49) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL17373675 | 0.72 | SMN1; SMN2 (0.59) | HDAC6HDAC3HDAC4HDAC1HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104945324-A | Sulfur-based compound with anti-tumor activity and application thereof | UNIV SHENYANG PHARMACEUTICAL | 2015-09-30 | — | — | CN | claimed |
| CN-104945324-A | Sulfur-based compound with anti-tumor activity and application thereof | UNIV SHENYANG PHARMACEUTICAL | 2015-09-30 | — | — | CN | disclosed |