Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DUSP3 | P51452 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.48 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 6/20 | 0.44 |
| ▸ | POLB | P06746 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 11/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.41 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17930419 | 0.87 | DUSP3 (0.44) | DUSP3PTPN11CTDSP1LMNAPOLB | |
| SCHEMBL16547642 | 0.85 | MAPT (0.48) | DUSP3PTPN11CTDSP1LMNAPOLB | |
| SCHEMBL17924171 | 0.85 | MAPT (0.48) | DUSP3PTPN11CTDSP1LMNAPOLB | |
| SCHEMBL16547794 | 0.80 | MAPT (0.47) | DUSP3PTPN11CTDSP1LMNAPOLB | |
| SCHEMBL17924233 | 0.80 | MAPT (0.47) | DUSP3PTPN11CTDSP1LMNAPOLB | |
| SCHEMBL17924169 | 0.80 | MAPT (0.61) | DUSP3PTPN11CTDSP1LMNAPOLB | |
| SCHEMBL16547646 | 0.80 | MAPT (0.61) | DUSP3PTPN11CTDSP1LMNAPOLB | |
| SCHEMBL16539443 | 0.79 | MAPT (0.55) | LMNAPOLBMEN1KMT2ANPSR1 | |
| SCHEMBL16539440 | 0.79 | MAPT (0.55) | LMNAPOLBMEN1KMT2ANPSR1 | |
| SCHEMBL16539242 | 0.78 | MAOA (0.50) | DUSP3PTPN11CTDSP1LMNAMEN1 |
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-9604933-B2 | Pyrazolochalcones as potential anticancer agents | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2017-03-28 | — | — | US | disclosed |