Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NCF1 | P14598 | 7/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2455863 | 0.83 | CYP2D6 (0.45) | KDM4EALDH1A1SMN1; SMN2NPC1MAPT | |
| SCHEMBL29956732 | 0.80 | NQO1 (0.41) | KDM4EALDH1A1SMN1; SMN2NPC1MAPT | |
| SCHEMBL19282141 | 0.80 | NQO1 (0.41) | KDM4EALDH1A1SMN1; SMN2NPC1MAPT | |
| SCHEMBL13097217 | 0.78 | CYP2D6 (0.43) | MAPT | |
| SCHEMBL21646059 | 0.76 | ALDH1A1 (0.41) | KDM4EMAPK1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL21645923 | 0.76 | GSTP1 (0.42) | KDM4EALDH1A1TSHR | |
| SCHEMBL1208300 | 0.76 | CCR1 (0.55) | KDM4EMAPK1ALDH1A1MAPT | |
| SCHEMBL29601133 | 0.76 | CCR1 (0.55) | KDM4EMAPK1ALDH1A1MAPT | |
| SCHEMBL17356164 | 0.76 | CCR1 (0.32) | KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL29992466 | 0.75 | MAOB (0.58) | KDM4EMAPK1ALDH1A1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-9926290-B2 | Inhibitors of INV(16) leukemia | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2018-03-27 | — | — | US | disclosed |