Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 1/20 | 0.61 |
| ▸ | MAOA | P21397 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | P4HB | P07237 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | ELANE | P08246 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9713854 | 0.82 | HKDC1 (0.65) | MAPTMAPK1TDP1KDM4EMEN1 | |
| SCHEMBL5793791 | 0.78 | MAOA (0.72) | STAT3MAOAMAPTMAPK1TDP1 | |
| SCHEMBL30003218 | 0.78 | MAOA (0.72) | STAT3MAOAMAPTMAPK1TDP1 | |
| Droserone SCHEMBL5858407 | 0.75 | MAOA (0.67) | STAT3MAOAMAPTMAPK1TDP1 | |
| Droserone SCHEMBL30003199 | 0.75 | MAOA (0.67) | STAT3MAOAMAPTMAPK1TDP1 | |
| SCHEMBL15413526 | 0.75 | MAPT (0.59) | MAOAMAPTMAPK1TDP1ALDH1A1 | |
| SCHEMBL15367855 | 0.73 | MAOA (0.58) | STAT3MAOAMAPTMAPK1TDP1 | |
| SCHEMBL17249988 | 0.73 | P4HB (0.81) | MAOAMAPTMAPK1TDP1ALDH1A1 | |
| SCHEMBL17250105 | 0.73 | P4HB (0.63) | STAT3MAOAMAPTMAPK1TDP1 | |
| SCHEMBL30594083 | 0.73 | MEN1 (0.55) | STAT3MAOAMAPTMAPK1TDP1 |
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 |