Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 2/20 | 0.47 |
| ▸ | TNK2 | Q07912 | 6/20 | 0.42 |
| ▸ | EGFR | P00533 | 8/20 | 0.38 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.36 |
| ▸ | ERBB3 | P21860 | 3/20 | 0.36 |
| ▸ | ERBB4 | Q15303 | 3/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 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 | |
|---|---|---|---|---|
| SCHEMBL122915 | 0.88 | BTK (0.60) | BTKTNK2HTR1ASLC6A2SLC6A4 | |
| SCHEMBL122300 | 0.83 | BTK (0.61) | BTKTNK2HTR1ASLC6A2SLC6A4 | |
| SCHEMBL167539 | 0.83 | BTK (0.61) | BTKTNK2HTR1ASLC6A2SLC6A4 | |
| SCHEMBL175374 | 0.76 | BTK (0.69) | BTKTNK2HTR2CHTR2B | |
| SCHEMBL170027 | 0.76 | BTK (0.61) | BTKTNK2 | |
| SCHEMBL123477 | 0.75 | BTK (0.56) | BTKTNK2HTR1ASLC6A2SLC6A4 | |
| SCHEMBL169823 | 0.74 | BTK (0.61) | BTKTNK2 | |
| SCHEMBL168773 | 0.74 | TNK2 (0.50) | BTKTNK2 | |
| SCHEMBL122913 | 0.73 | BTK (0.60) | BTKTNK2 | |
| SCHEMBL121733 | 0.72 | BTK (0.54) | BTKTNK2HTR1ASLC6A2SLC6A4 |
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-2424368-A1 | PYRROLOTRIAZINE COMPOUNDS | Locus Pharmaceuticals, Inc. (US) | 2012-03-07 | — | — | EP | disclosed |
| WO-2010126960-A1 | PYRROLOTRIAZINE COMPOUNDS | LOCUS PHARMACEUTICALS, INC. (US) | 2010-11-04 | — | — | WO | disclosed |