Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PLK1 | P53350 | 1/20 | 0.33 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.33 |
| ▸ | PLK2 | Q9NYY3 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL5806404 | 0.91 | CYP1A2 (0.48) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5808972 | 0.89 | CYP1A2 (0.45) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5806802 | 0.89 | CYP1A2 (0.48) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5811230 | 0.87 | CYP1A2 (0.46) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5808684 | 0.86 | CYP1A2 (0.42) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5811016 | 0.86 | CYP1A2 (0.46) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5812303 | 0.86 | CYP1A2 (0.46) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5810152 | 0.85 | CYP1A2 (0.45) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5806462 | 0.85 | CYP1A2 (0.45) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5808968 | 0.84 | CYP1A2 (0.53) | CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6 |
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-2006025717-A1 | PYRROLO[2,3-c]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2006-03-09 | — | — | WO | claimed |