Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.65 |
| ▸ | USP2 | O75604 | 2/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | ABCG2 | Q9UNQ0 | 6/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.50 |
| ▸ | RELA | Q04206 | 2/20 | 0.50 |
| ▸ | DPP4 | P27487 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL827858 | 0.90 | CYP3A4 (0.53) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL9119401 | 0.88 | SYNJ2 (0.54) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL21275479 | 0.85 | CYP3A4 (0.67) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL30002388 | 0.85 | CYP3A4 (0.67) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL30506419 | 0.85 | CYP3A4 (0.67) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL2874467 | 0.85 | CYP3A4 (0.67) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL11105157 | 0.83 | CYP3A4 (0.65) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL12301477 | 0.83 | CYP3A4 (0.65) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL7905410 | 0.82 | CYP3A4 (0.47) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 | |
| SCHEMBL7228401 | 0.82 | CYP3A4 (0.46) | CYP3A4USP2MAPK1SMN1; SMN2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015027833-A1 | CYCLOPENTADIONE OXIME ESTER AND APPLICATION THEREOF | 北京英力科技发展有限公司 (CN) | 2015-03-05 | — | — | WO | disclosed |
| WO-2015027702-A1 | CYCLOPENTANEDIONE OXIME ESTER AND APPLICATION THEREOF | 北京英力科技发展有限公司 (CN) | 2015-03-05 | — | — | WO | disclosed |
| US-RE37094-E1 | Heterocyclic substituted acylaminothiazoles, their preparation and pharmaceutical compositions containing them | SANOFI (FR) | 2001-03-13 | — | — | US | disclosed |
| US-5189049-A | Cholecystokinin and gastrin inhibitors | SANOFI (FR) | 1993-02-23 | — | — | US | disclosed |