Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MYC | P01106 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 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 | |
|---|---|---|---|---|
| SCHEMBL4649024 | 0.81 | HDAC4 (0.34) | HDAC4HDAC3HDAC1HDAC2 | |
| SCHEMBL4966294 | 0.77 | NPC1 (0.41) | PDK2HDAC4NPC1RAB9AKDM4E | |
| SCHEMBL4967042 | 0.72 | PDK2 (0.37) | PDK2HDAC4NPC1RAB9AKDM4E | |
| SCHEMBL4966801 | 0.71 | RHOA (0.42) | PDK2HDAC4SLC9A1HDAC1IMPDH2 | |
| SCHEMBL4966287 | 0.70 | NPC1 (0.41) | PDK2HDAC4NPC1RAB9AKDM4E | |
| SCHEMBL4967217 | 0.70 | IMPDH2 (0.46) | PDK2HDAC4NPC1RAB9AKDM4E | |
| SCHEMBL4967421 | 0.67 | PDK2 (0.38) | PDK2SLC9A1HDAC1KMT2AIMPDH2 | |
| SCHEMBL4966757 | 0.65 | PDK2 (0.37) | PDK2HDAC4SLC9A1NPC1RAB9A | |
| SCHEMBL14263248 | 0.65 | PDK2 (0.37) | PDK2HDAC4SLC9A1NPC1RAB9A | |
| SCHEMBL4967035 | 0.65 | PDK2 (0.37) | PDK2HDAC4SLC9A1NPC1RAB9A |
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-1963287-A1 | GLUCOCORTICOID RECEPTOR MODULATORS AS ANTIINFLAMMATORY AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007065828-A1 | GLUCOCORTICOID RECEPTOR MODULATORS AS ANTIINFLAMMATORY AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-06-14 | — | — | WO | disclosed |