Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 3/20 | 0.54 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | CSNK2A2 | P19784 | 4/20 | 0.35 |
| ▸ | CSNK2B | P67870 | 3/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.33 |
| ▸ | PIM1 | P11309 | 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 | |
|---|---|---|---|---|
| SCHEMBL16502698 | 0.85 | TNF (0.54) | TNFHIPK2SLC22A12CSNK2A2CSNK2B | |
| SCHEMBL7917731 | 0.84 | TNF (0.49) | TNFHIPK2KDM4ECYP1A1CYP1A2 | |
| SCHEMBL7916601 | 0.81 | TNF (0.43) | TNFHIPK2HTR2CHDAC6KDM4E | |
| SCHEMBL7920176 | 0.78 | CCR1 (0.46) | HDAC6KDM4ECYP3A4CYP2D6 | |
| SCHEMBL16502680 | 0.78 | CYP19A1 (0.51) | TNFHIPK2MAPK10KDM4ECSNK2A2 | |
| SCHEMBL7917427 | 0.77 | F2 (0.41) | TNFHDAC6KDM4E | |
| SCHEMBL7920129 | 0.76 | TNF (0.45) | TNFHDAC6KDM4ECYP1A2 | |
| SCHEMBL16502832 | 0.76 | SLC9A1 (0.49) | TNFHIPK2HTR2C | |
| SCHEMBL7918345 | 0.76 | CYP1A2 (0.40) | KDM4ECYP1A1CYP1A2CYP1B1 | |
| SCHEMBL7916817 | 0.76 | AKR1C3 (0.41) | HDAC6KDM4ECYP1A1CYP1A2CYP1B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010090304-A1 | ACYLGUANIDINE DERIVATIVE | アステラス製薬株式会社 (JP) | 2010-08-12 | — | — | WO | disclosed |