Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | NSD2 | O96028 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HPGDS | O60760 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL362412 | 0.88 | CASP6 (0.38) | CASP6BRD4SCN9ATDP2NSD2 | |
| SCHEMBL314058 | 0.80 | TDP1 (0.42) | BRD4TDP2NSD2ABL1PLCG1 | |
| SCHEMBL1919495 | 0.70 | HPGDS (0.52) | BRD4HPGDSADRA1AADRA1DADRA2A | |
| SCHEMBL20599370 | 0.68 | PIN1 (0.43) | BRD4MEN1KMT2AHPGDSADRA1A | |
| SCHEMBL31734567 | 0.68 | BRD4 (0.41) | BRD4TDP2NSD2ABL1PLCG1 | |
| SCHEMBL30792106 | 0.68 | MAP4K4 (0.44) | BRD4HPGDSADRA1AADRA1DADRA2A | |
| SCHEMBL20819423 | 0.68 | HPGDS (0.51) | BRD4TDP2NSD2ABL1PLCG1 | |
| SCHEMBL20819420 | 0.67 | KDM4E (0.46) | BRD4BLMTDP1HPGDSGAA | |
| SCHEMBL26259967 | 0.67 | BRD4 (0.53) | BRD4TDP1HPGDSGAAADRA1A | |
| SCHEMBL13733684 | 0.67 | CASP6 (0.40) | CASP6MEN1KMT2AGAAALDH1A1 |
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-8097594-B2 | Macrolides and ketolides having antimicrobial activity | WOCKHARDT LTD. (IN) | 2012-01-17 | — | — | US | disclosed |