Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.40 |
| ▸ | ABL1 | P00519 | 2/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | HCK | P08631 | 2/20 | 0.40 |
| ▸ | SRC | P12931 | 2/20 | 0.40 |
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.40 |
| ▸ | MTOR | P42345 | 2/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.40 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.40 |
| ▸ | PRKDC | P78527 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28624707 | 0.80 | RIPK2 (0.46) | ADORA2AADORA1KDM4ERIPK2PIK3CD | |
| SCHEMBL8355956 | 0.76 | RIPK2 (0.71) | RIPK2SRCKDR | |
| SCHEMBL28624694 | 0.76 | SRC (0.48) | RIPK2PIK3CDABL1EGFRHCK | |
| SCHEMBL24133460 | 0.75 | RIPK2 (0.39) | ADORA2AADORA1KDM4ERIPK2ALDH1A1 | |
| SCHEMBL8357891 | 0.75 | HPGD (0.51) | ADORA2AADORA1RIPK2HSD17B10ALDH1A1 | |
| SCHEMBL8308145 | 0.74 | HPGD (0.49) | ADORA2AADORA1KDM4ERIPK2ALDH1A1 | |
| SCHEMBL8309258 | 0.74 | ADORA1 (0.48) | ADORA2AADORA1KDM4ERIPK2ALDH1A1 | |
| SCHEMBL3691443 | 0.73 | KDM4E (0.50) | ADORA2AADORA1KDM4EHSD17B10MAPK1 | |
| SCHEMBL15613500 | 0.73 | ADORA1 (0.47) | ADORA2AADORA1KDM4ERIPK2ALDH1A1 | |
| SCHEMBL28614010 | 0.72 | MAPT (0.51) | ADORA2AADORA1KDM4ERIPK2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5922741-A | 5-aminopyrazoles useful as tyrosine kinase inhibitors | CELLTECH THERAPEUTICS LTD. (GB) | 1999-07-13 | — | — | US | disclosed |
| EP-0906286-A1 | 5-AMINOPYRAZOLES USEFUL AS SELECTIVE INHIBITORS OF THE PROTEIN TYROSINE KINASE P56ICK | CELLTECH THERAPEUTICS LIMITED (GB) | 1999-04-07 | — | — | EP | disclosed |
| WO-1997040019-A1 | 5-AMINOPYRAZOLES USEFUL AS SELECTIVE INHIBITORS OF THE PROTEIN TYROSINE KINASE P56ICK | CELLTECH THERAPEUTICS LIMITED (GB) | 1997-10-30 | — | — | WO | disclosed |