Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | AHR | P35869 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | MPO | P05164 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | SGMS2 | Q8NHU3 | 2/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5809081 | 0.87 | MPO (0.42) | CYP1A2CYP3A4CYP2C9CYP2C19MPO | |
| SCHEMBL5806654 | 0.87 | MPO (0.42) | CYP1A2CYP3A4CYP2C9CYP2C19AHR | |
| SCHEMBL5809111 | 0.86 | CNR2 (0.49) | CYP1A2CYP3A4CYP2C9CYP2C19AHR | |
| SCHEMBL5807474 | 0.84 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2C9CYP2C19AHR | |
| SCHEMBL5811682 | 0.83 | MAOA (0.47) | CYP1A2CYP3A4CYP2C9CYP2C19AHR | |
| SCHEMBL5811165 | 0.82 | CYP1A2 (0.42) | CYP1A2CYP3A4CYP2C9CYP2C19AHR | |
| SCHEMBL5806157 | 0.80 | ABCB1 (0.43) | CYP1A2CYP3A4CYP2C9CYP2C19AHR | |
| SCHEMBL5810147 | 0.77 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C9CYP2C19AHR | |
| SCHEMBL5811668 | 0.77 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2C9CYP2C19AHR | |
| SCHEMBL5810331 | 0.77 | CYP1A2 (0.39) | CYP1A2CYP3A4CYP2C9CYP2C19MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006025717-A1 | PYRROLO[2,3-c]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2006-03-09 | — | — | WO | claimed |
| WO-2006025717-A1 | PYRROLO[2,3-c]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2006-03-09 | — | — | WO | disclosed |