Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | RAF1 | P04049 | 3/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HPGDS | O60760 | 1/20 | 0.31 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.31 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.30 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.30 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.30 |
| ▸ | PRKACA | P17612 | 1/20 | 0.30 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.30 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.30 |
| ▸ | CLK4 | Q9HAZ1 | 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 | |
|---|---|---|---|---|
| SCHEMBL6654480 | 1.00 | CYP2A6 (0.41) | CYP2A6RAF1HDAC1KDM1AHDAC6 | |
| SCHEMBL6753903 | 0.80 | CYP2A6 (0.49) | CYP2A6RAF1HDAC1KDM1AHDAC6 | |
| SCHEMBL4814697 | 0.77 | CYP2A6 (0.52) | CYP2A6RAF1MEN1DYRK1AMKNK2 | |
| SCHEMBL4822196 | 0.76 | PTGS2 (0.42) | HDAC1KDM1AHDAC6MKNK2PTGS2 | |
| SCHEMBL6655430 | 0.76 | CLK4 (0.44) | CYP2A6HDAC1KDM1AHDAC6NPC1 | |
| SCHEMBL6226582 | 0.73 | CLK4 (0.44) | CYP2A6KDM1AMEN1NPC1RAB9A | |
| SCHEMBL23501621 | 0.67 | CYP2A6 (0.48) | CYP2A6MKNK2 | |
| SCHEMBL5027205 | 0.67 | CYP2A6 (0.48) | CYP2A6MEN1NPC1RAB9AKMT2A | |
| SCHEMBL5799279 | 0.67 | PTK2 (0.52) | CYP2A6MEN1NPC1RAB9AKMT2A | |
| SCHEMBL29933971 | 0.67 | CYP2A6 (0.48) | CYP2A6MEN1NPC1RAB9AKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1430068-A1 | 6-O-CARBAMATE-11,12-LACTO-KETOLIDE ANTIMICROBIALS | Ortho-Mcneil Pharmaceutical, Inc. (US) | 2004-06-23 | — | — | EP | disclosed |
| WO-2003024986-A1 | 6-O-CARBAMATE-11,12-LACTO-KETOLIDE ANTIMICROBIALS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2003-03-27 | — | — | WO | disclosed |