Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHKA | P35790 | 1/20 | 0.45 |
| ▸ | METAP1 | P53582 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KHK | P50053 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8681378 | 0.77 | CHKA (0.46) | CHKAMAPTKDM4EGAASMN1; SMN2 | |
| SCHEMBL7401781 | 0.75 | HRH3 (0.51) | MAPTSMN1; SMN2 | |
| SCHEMBL7401777 | 0.74 | PPARG (0.45) | SMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL7334978 | 0.73 | CHKA (0.61) | CHKAMAPTKDM4EGAASMN1; SMN2 | |
| SCHEMBL18590696 | 0.73 | CHKA (0.67) | CHKAMAPTKDM4EGAACA12 | |
| SCHEMBL8636540 | 0.72 | GAA (0.62) | CHKAMAPTKDM4EGAACA12 | |
| SCHEMBL7398706 | 0.72 | DRD2 (0.55) | CHKAMAPTKDM4EGAAKHK | |
| SCHEMBL7330427 | 0.72 | PPARG (0.45) | — | |
| SCHEMBL28302485 | 0.72 | HSD17B10 (0.43) | ALOX5USP2MEN1ALDH1A1KMT2A | |
| SCHEMBL1424248 | 0.72 | ALOX5 (0.59) | MAPTALOX5MAPK14SMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |
| US-5728701-A | INHIBIT PLATELET AGGREGATION | ZENECA LIMITED (GB) | 1998-03-17 | — | — | US | disclosed |