Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APOBEC3A | P31941 | 1/20 | 0.47 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.47 |
| ▸ | NCF1 | P14598 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4043905 | 0.90 | NCF1 (0.44) | APOBEC3AAPOBEC3GNCF1ALOX5CYP1A2 | |
| SCHEMBL85903 | 0.86 | ALOX5 (0.55) | APOBEC3AAPOBEC3GHSD17B10ALOX5TP53 | |
| SCHEMBL16814950 | 0.80 | ROCK1 (0.49) | NCF1ALDH1A1GAATSHRSMN1; SMN2 | |
| SCHEMBL10363439 | 0.80 | APOBEC3A (0.44) | APOBEC3AAPOBEC3GHSD17B10ALOX5TP53 | |
| SCHEMBL7787664 | 0.79 | HSD17B10 (0.53) | APOBEC3AAPOBEC3GHSD17B10TP53ALOX5AP | |
| SCHEMBL1196908 | 0.78 | KMT2A (0.45) | HSD17B10ALDH1A1KDM4EGAACYP1A2 | |
| SCHEMBL7594648 | 0.78 | NR1H2 (0.54) | APOBEC3AAPOBEC3GHSD17B10ALOX5TP53 | |
| SCHEMBL1922222 | 0.78 | HSD17B10 (0.43) | APOBEC3AAPOBEC3GHSD17B10ALDH1A1KDM4E | |
| SCHEMBL4045251 | 0.78 | HSD17B10 (0.43) | HSD17B10TP53ALOX5APFEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL2528270 | 0.77 | HSD17B10 (0.42) | HSD17B10TP53ALOX5APFEN1ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2820020-B1 | PYRAZOLO-TRIAZINE DERIVATIVES AS SELECTIVE CYCLIN-DEPENDENT KINASE INHIBITORS | LEAD DISCOVERY CENTER GMBH (DE) | 2016-04-06 | — | — | EP | disclosed |
| WO-2013128028-A1 | PYRAZOLO - TRIAZINE DERIVATIVES AS SELECTIVE CYCLIN- DEPENDENT KINASE INHINITORS | LEAD DISCOVERY CENTER GMBH (DE) | 2013-09-06 | — | — | WO | disclosed |
| EP-2634190-A1 | Pyrazolo-triazine derivatives as selective cyclin-dependent kinase inhinitors | Lead Discovery Center GmbH (DE) | 2013-09-04 | — | — | EP | disclosed |
| EP-0184170-B1 | AMINOMETHYL OXOOXAZOLIDINYL BENZENE DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-10-16 | — | — | EP | disclosed |