Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HKDC1 | Q2TB90 | 2/20 | 0.79 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | CDC25B | P30305 | 8/20 | 0.53 |
| ▸ | CDC25A | P30304 | 6/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.53 |
| ▸ | MAP2K7 | O14733 | 3/20 | 0.46 |
| ▸ | S100A4 | P26447 | 5/20 | 0.43 |
| ▸ | NSD2 | O96028 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL17250422 | 0.82 | HKDC1 (0.56) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL10502055 | 0.81 | MAPT (0.70) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL31171425 | 0.77 | MEN1 (0.55) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL9713854 | 0.77 | HKDC1 (0.65) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL17249963 | 0.74 | MAPT (0.56) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL29967684 | 0.73 | HKDC1 (0.51) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL17250512 | 0.73 | IDO1 (0.56) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL17250427 | 0.71 | MAPT (0.53) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL20046959 | 0.71 | HKDC1 (0.50) | HKDC1MAPTTDP1L3MBTL1MEN1 | |
| SCHEMBL17250098 | 0.70 | MAPT (0.56) | HKDC1MAPTTDP1L3MBTL1MEN1 |
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-2015172076-A1 | NAPHTHAQUINONE METHYLTRANSFERASE INHIBITORS AND USES THEREOF | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2015-11-12 | — | — | WO | disclosed |