Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HKDC1 | Q2TB90 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | CDC25B | P30305 | 9/20 | 0.49 |
| ▸ | CDC25A | P30304 | 7/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.49 |
| ▸ | S100A4 | P26447 | 6/20 | 0.42 |
| ▸ | MAP2K7 | O14733 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17250100 | 0.82 | HKDC1 (0.79) | HKDC1MAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL10502055 | 0.77 | MAPT (0.70) | HKDC1MAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL17249970 | 0.73 | MAPT (0.57) | HKDC1MAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL9713854 | 0.73 | HKDC1 (0.65) | HKDC1MAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL10694531 | 0.73 | CDC25B (0.50) | MAPTL3MBTL1MEN1KMT2ANPSR1 | |
| SCHEMBL28746047 | 0.72 | MAPT (0.50) | HKDC1MAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL9326033 | 0.71 | MAOA (0.55) | HKDC1MAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL10615443 | 0.71 | AURKA (0.50) | MAPTL3MBTL1MEN1KMT2ANPSR1 | |
| SCHEMBL17242653 | 0.71 | HKDC1 (0.49) | HKDC1MAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL17249963 | 0.70 | MAPT (0.56) | HKDC1MAPTL3MBTL1MEN1KMT2A |
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 |