Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | EP300 | Q09472 | 1/20 | 0.35 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5872462 | 1.00 | HDAC8 (0.36) | HDAC8DDB1CRBNTLR9CA2 | |
| SCHEMBL31403360 | 1.00 | HDAC8 (0.36) | HDAC8DDB1CRBNTLR9CA2 | |
| SCHEMBL6941289 | 0.79 | TSHR (0.34) | POLBTSHRCYP1A2CYP2C19KMT2A | |
| SCHEMBL2369273 | 0.79 | LMNA (0.42) | HDAC8DDB1CRBNTLR9CA2 | |
| SCHEMBL531694 | 0.79 | LMNA (0.42) | HDAC8DDB1CRBNTLR9CA2 | |
| SCHEMBL531693 | 0.79 | LMNA (0.42) | HDAC8DDB1CRBNTLR9CA2 | |
| SCHEMBL5872352 | 0.78 | GAA (0.35) | GAAPOLBTSHRHTTCYP1A2 | |
| SCHEMBL5872354 | 0.78 | GAA (0.35) | GAAPOLBTSHRHTTCYP1A2 | |
| SCHEMBL7780090 | 0.77 | MMP2 (0.38) | CYP1A2CYP3A4CYP2C19KMT2A | |
| SCHEMBL13949518 | 0.74 | LMNA (0.38) | HDAC8DDB1CRBNTLR9CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7126028-B1 | Process for preparing chiral compounds | THE UNIVERSITY COURT OF THE UNIVERSITY OF ST. ANDREWS (GB) | 2006-10-24 | — | — | US | disclosed |
| EP-1135349-A1 | PROCESS FOR PREPARING CHIRAL COMPOUNDS | UNIVERSITY OF DURHAM (GB) | 2001-09-26 | — | — | EP | disclosed |
| WO-2000034210-A1 | PROCESS FOR PREPARING CHIRAL COMPOUNDS | UNIVERSITY OF DURHAM (GB) | 2000-06-15 | — | — | WO | disclosed |