Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5907641 | 0.84 | ALDH1A1 (0.36) | ALDH1A1TSHRHPGD | |
| SCHEMBL25963585 | 0.82 | MEN1 (0.43) | ALDH1A1TSHRHRH4HRH3POLB | |
| SCHEMBL17482389 | 0.78 | TSHR (0.38) | ALDH1A1TSHRHRH4HRH3POLB | |
| SCHEMBL8436376 | 0.78 | TSHR (0.38) | ALDH1A1TSHRHRH4HRH3POLB | |
| SCHEMBL5907680 | 0.77 | CYP2D6 (0.52) | ALDH1A1KMT2AHPGDCYP2D6CYP2C19 | |
| SCHEMBL25963591 | 0.76 | ALDH1A1 (0.37) | ALDH1A1TSHRHRH4HRH3POLB | |
| SCHEMBL25963587 | 0.76 | TSHR (0.35) | TSHRHRH4HRH3HDAC7HDAC8 | |
| SCHEMBL6722463 | 0.75 | HRH4 (0.43) | ALDH1A1TSHRHRH4HRH3HDAC7 | |
| SCHEMBL5907647 | 0.75 | ALDH1A1 (0.48) | ALDH1A1KMT2A | |
| SCHEMBL8436494 | 0.75 | TSHR (0.42) | TSHRHRH4HRH3HDAC7HDAC8 |
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-20060046286-A1 | Method for preparing optically active beta-butyrolactones | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2006-03-02 | — | — | US | disclosed |