Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | NAAA | Q02083 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4353043 | 0.88 | LMNA (0.65) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| Hydrochloric Acid SCHEMBL4349771 | 0.87 | LMNA (0.64) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| Hydrochloric Acid SCHEMBL148164 | 0.81 | BCHE (0.48) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| SCHEMBL11445935 | 0.78 | LMNA (0.77) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| SCHEMBL14205220 | 0.77 | LMNA (0.53) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| SCHEMBL14178703 | 0.75 | HCRTR1 (0.51) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| SCHEMBL30555944 | 0.74 | DRD2 (0.61) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| SCHEMBL11445243 | 0.74 | DRD2 (0.61) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| SCHEMBL2935208 | 0.74 | DRD2 (0.61) | KDM4EALDH1A1HSD17B10LMNAALOX15 | |
| SCHEMBL2935206 | 0.74 | DRD2 (0.61) | KDM4EALDH1A1HSD17B10LMNAALOX15 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011022518-A1 | 1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVES EFFECTIVE AS ANTIGLIOMA AGENTS, METHODS OF MAKING, AND THEIR USE | UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) | 2011-02-24 | — | — | WO | disclosed |