Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | HKDC1 | Q2TB90 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | CDC25A | P30304 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | APAF1 | O14727 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17250429 | 0.99 | S100A4 (0.44) | S100A4KMT2AMEN1HKDC1MAPT | |
| SCHEMBL17250421 | 0.77 | LMNA (0.45) | KMT2AMEN1MAPTNPSR1L3MBTL1 | |
| SCHEMBL11798271 | 0.75 | MAPT (0.56) | KMT2AMEN1HKDC1MAPTNPSR1 | |
| SCHEMBL10502055 | 0.75 | MAPT (0.70) | S100A4KMT2AMEN1HKDC1MAPT | |
| SCHEMBL17250098 | 0.74 | MAPT (0.56) | S100A4KMT2AMEN1HKDC1MAPT | |
| SCHEMBL17249963 | 0.74 | MAPT (0.56) | S100A4KMT2AMEN1HKDC1MAPT | |
| SCHEMBL17249971 | 0.74 | MAPT (0.54) | KMT2AMEN1HKDC1MAPTNPSR1 | |
| SCHEMBL11798305 | 0.74 | MAPT (0.54) | KMT2AMEN1HKDC1MAPTNPSR1 | |
| SCHEMBL17249970 | 0.71 | MAPT (0.57) | S100A4KMT2AMEN1HKDC1MAPT | |
| SCHEMBL17249922 | 0.70 | HKDC1 (0.50) | S100A4KMT2AMEN1HKDC1MAPT |
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 |