Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | UBE2M | P61081 | 1/20 | 0.38 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4229410 | 0.95 | HRH1 (0.41) | HRH1HDAC3HDAC2HDAC1HDAC8 | |
| SCHEMBL4223485 | 0.93 | MAPT (0.45) | HRH1HDAC3HDAC1HDAC8ALDH1A1 | |
| SCHEMBL4235025 | 0.92 | CASR (0.46) | HRH1HDAC3HDAC2HDAC1HDAC8 | |
| SCHEMBL4233205 | 0.90 | CASR (0.46) | HRH1HDAC3HDAC2HDAC1HDAC8 | |
| SCHEMBL4233301 | 0.88 | METAP1 (0.45) | HRH1ALDH1A1TSHRUBE2MDCUN1D1 | |
| SCHEMBL2384055 | 0.86 | HDAC3 (0.41) | HDAC3HDAC2HDAC1HDAC8ALDH1A1 | |
| SCHEMBL2385731 | 0.84 | UTS2R (0.46) | HDAC3HDAC2HDAC1HDAC8ALDH1A1 | |
| SCHEMBL4229607 | 0.83 | HDAC1 (0.43) | HDAC3HDAC2HDAC1HDAC8DYRK1A | |
| SCHEMBL3829026 | 0.83 | CYP2D6 (0.50) | HDAC3HDAC2HDAC1HDAC8ALDH1A1 | |
| SCHEMBL4229354 | 0.83 | METAP1 (0.46) | HRH1ALDH1A1TSHRUBE2MDCUN1D1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2133339-A1 | NOVEL (2-AMINOPHENYL)PYRIDINECARBOXAMIDE DERIVATIVE HAVING UREA STRUCTURE | Santen Pharmaceutical Co., Ltd (JP) | 2009-12-16 | — | — | EP | disclosed |