Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | SLC12A2 | P55011 | 1/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | CISD1 | Q9NZ45 | 5/20 | 0.42 |
| ▸ | AQP1 | P29972 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14886016 | 0.91 | KDM4E (0.57) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL2879247 | 0.89 | CA2 (0.68) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL14882371 | 0.88 | ALDH1A1 (0.48) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL14885987 | 0.86 | ALDH1A1 (0.47) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL14885992 | 0.86 | ALDH1A1 (0.47) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL21019023 | 0.83 | KDM4E (0.50) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL16581037 | 0.81 | CA2 (0.58) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL2741860 | 0.81 | KDM4E (0.82) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL2878058 | 0.80 | CA2 (0.59) | KDM4EUSP2ALDH1A1CA2LMNA | |
| SCHEMBL16577874 | 0.80 | KDM4E (0.47) | KDM4EUSP2ALDH1A1CA2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013059648-A1 | 2,3,5 TRISUBSTITUTED ARYL AND HETEROARYL AMINO DERIVATIVES, COMPOSITIONS, AND METHODS OF USE | NEUROTHERAPEUTICS PHARMA, INC. (US) | 2013-04-25 | — | — | WO | disclosed |
| WO-2013059648-A1 | 2,3,5 TRISUBSTITUTED ARYL AND HETEROARYL AMINO DERIVATIVES, COMPOSITIONS, AND METHODS OF USE | NEUROTHERAPEUTICS PHARMA, INC. (US) | 2013-04-25 | — | — | WO | disclosed |