Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | USP1 | O94782 | 1/20 | 0.37 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7091910 | 0.88 | L3MBTL1 (0.46) | CDC7HDAC1HDAC3HDAC6CHRM4 | |
| SCHEMBL7886097 | 0.86 | NOS2 (0.52) | HDAC1HDAC3HDAC6SMN1; SMN2EGFR | |
| SCHEMBL7092191 | 0.80 | CXCR4 (0.51) | CDC7HDAC1HDAC6HPGDKDM4E | |
| SCHEMBL7095837 | 0.78 | MEN1 (0.51) | HDAC6HPGDKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL7096045 | 0.77 | LRRK2 (0.43) | HDAC1HDAC3EGFR | |
| SCHEMBL7090927 | 0.76 | GAA (0.46) | HDAC1KDM4EMAPTL3MBTL1EGFR | |
| SCHEMBL7094580 | 0.74 | RAB9A (0.46) | HDAC1HDAC6KDM4EUSP1WDR48 | |
| SCHEMBL7097039 | 0.73 | EGFR (0.42) | HPGDALDH1A1NPSR1EGFRMEN1 | |
| SCHEMBL7097405 | 0.73 | KDM4E (0.41) | HPGDKDM4EALDH1A1MAPTL3MBTL1 | |
| SCHEMBL7094936 | 0.73 | TMEM97 (0.38) | HDAC1KDM4EALDH1A1EGFRMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268437-A1 | INHIBITORS OF PROTEIN KINASES | Knoll GmbH (DE) | 2003-01-02 | — | — | EP | disclosed |
| WO-2002030908-A1 | INHIBITORS OF PROTEIN KINASES | KNOLL GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |
| US-6297238-B1 | 3-ARYL PYRAZOLES WITH 4,5(3,4)-BICYCLIC RING FUSION WHICH ARE INHIBITORS OF PROTEIN KINASES PARTICULARLY TYROSINE KINASES AND SERINE/THREONINE KINASES | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-02 | — | — | US | disclosed |