Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 3/20 | 0.50 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.43 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | NEK2 | P51955 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL412466 | 0.84 | BRAF (0.49) | BRAFMAP2K1CYP3A4KDRCYP2C19 | |
| SCHEMBL8241090 | 0.83 | BRAF (0.47) | BRAFMAP2K1CYP3A4LRRK2KDR | |
| SCHEMBL14620776 | 0.81 | BRAF (0.45) | BRAFMAP2K1CYP3A4KDRMTNR1A | |
| SCHEMBL8248215 | 0.80 | BRAF (0.44) | BRAFMAP2K1CYP3A4KDRMTNR1A | |
| SCHEMBL411392 | 0.79 | BRAF (0.48) | BRAFMAP2K1SGMS2CYP3A4KDR | |
| SCHEMBL12028662 | 0.79 | BRAF (0.48) | BRAFMAP2K1CYP3A4KDRCYP2C19 | |
| SCHEMBL8252338 | 0.77 | BRAF (0.41) | BRAFMAP2K1CYP3A4KDRCYP2C19 | |
| SCHEMBL8249612 | 0.76 | BRAF (0.41) | BRAFMAP2K1KDRMTNR1ANEK2 | |
| SCHEMBL412855 | 0.76 | BRAF (0.53) | BRAFMAP2K1SGMS2CYP3A4LRRK2 | |
| SCHEMBL8249610 | 0.76 | BRAF (0.40) | BRAFMAP2K1CYP3A4KDRCYP2C19 |
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-2007002325-A1 | PYRROLO[2,3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | PLEXXIKON, INC. (US) | 2007-01-04 | — | — | WO | disclosed |
| WO-2007002433-A1 | PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | PLEXXIKON, INC. (US) | 2007-01-04 | — | — | WO | disclosed |