Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 7/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
| ▸ | LATS1 | O95835 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.37 |
| ▸ | PIP4K2C | Q8TBX8 | 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 | |
|---|---|---|---|---|
| SCHEMBL16373693 | 0.89 | FYN (0.46) | FYNEGFRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL16332660 | 0.87 | FYN (0.44) | FYNEGFRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL16332162 | 0.86 | FYN (0.42) | FYNLMNAHIF1ACYP1A2CYP3A4 | |
| SCHEMBL16331623 | 0.85 | FYN (0.51) | FYNKDM4EEGFRKMT2AMAPK1 | |
| SCHEMBL16332149 | 0.85 | FYN (0.42) | FYNGAAKDM4ELMNAEGFR | |
| SCHEMBL16332258 | 0.85 | FYN (0.51) | FYNKDM4ELMNAHIF1ACYP1A2 | |
| SCHEMBL16331336 | 0.85 | FYN (0.42) | FYNPIP4K2APIP4K2CCD38 | |
| SCHEMBL16332075 | 0.84 | FYN (0.40) | FYNLMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL16332052 | 0.83 | FYN (0.39) | FYNGAALMNAEGFRCYP1A2 | |
| SCHEMBL16331570 | 0.82 | ABL1 (0.53) | FYNKDM4ELMNAEGFRHTT |
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-2014207260-A1 | PYRROLO[3,2-C]PYRIDINE COMPOUNDS AS G-PROTEIN-COUPLED RECEPTOR KINASE 5 (GRK5) MODULATORS | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2014-12-31 | — | — | WO | disclosed |