Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 4/20 | 0.34 |
| ▸ | DRD4 | P21917 | 4/20 | 0.34 |
| ▸ | DRD3 | P35462 | 4/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1266772 | 0.88 | MAP2K1 (0.36) | MAP2K1DRD2DRD4DRD3CACNA1F | |
| SCHEMBL21872999 | 0.82 | MAP2K1 (0.41) | MAP2K1RPS6KA5KMT2AMETCDC7 | |
| SCHEMBL1266773 | 0.80 | DRD2 (0.35) | MAP2K1DRD2DRD4DRD3CACNA1F | |
| SCHEMBL878720 | 0.79 | CSF1R (0.48) | DRD3CYP1A2CYP3A4HTR1AADRA2A | |
| SCHEMBL4653270 | 0.79 | DRD4 (0.34) | MAP2K1DRD2DRD4DRD3CACNA1F | |
| SCHEMBL1267600 | 0.78 | AXL (0.44) | MAP2K1KMT2AMETCDC7PIM1 | |
| SCHEMBL857532 | 0.78 | MAP2K1 (0.41) | MAP2K1KMT2AMETCDC7PIM1 | |
| SCHEMBL12929006 | 0.77 | NPSR1 (0.35) | MAP2K1KMT2ALMNAPOLBCDC7 | |
| SCHEMBL411407 | 0.75 | TP53 (0.46) | CYP1A2CYP3A4CYP2D6NFKB1KMT2A | |
| SCHEMBL857798 | 0.74 | AXL (0.48) | MAP2K1DRD2DRD4DRD3KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1885723-A2 | PYRROLO[2,3-B]PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | PLEXXIKON, INC. (US) | 2008-02-13 | — | — | EP | disclosed |
| WO-2007013896-A2 | PYRROL (2,3-B) PYRIDINE DERIVATIVES PROTEIN KINASE INHIBITORS | PLEXXIKON, INC. (US) | 2007-02-01 | — | — | WO | disclosed |