Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TNF | P01375 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4760880 | 0.92 | KIT (0.33) | KITPTGS2 | |
| SCHEMBL3854179 | 0.91 | KIT (0.34) | KITPTGS2MAPTCYP1A2CYP3A4 | |
| SCHEMBL3850966 | 0.89 | KIT (0.34) | KITMAPTTP53CYP1A2CYP3A4 | |
| SCHEMBL3846696 | 0.88 | KIT (0.35) | KITPTGS2MAPTCYP1A2CYP3A4 | |
| SCHEMBL3854489 | 0.87 | PTGS2 (0.35) | KITPTGS2MAPTCYP1A2CYP3A4 | |
| SCHEMBL3851836 | 0.87 | ALDH1A1 (0.32) | KITCYP1A2CYP3A4CYP2D6KMT2A | |
| SCHEMBL3848257 | 0.86 | CYP1A2 (0.36) | KITMAPTTP53CYP1A2CYP3A4 | |
| SCHEMBL3855518 | 0.86 | PKM (0.41) | KITCYP1A2CYP3A4CYP2D6ALDH1A1 | |
| SCHEMBL3846935 | 0.86 | KIT (0.34) | KITPTGS2 | |
| SCHEMBL3855222 | 0.85 | CYP1A2 (0.34) | MAPTTP53CYP1A2CYP3A4CYP2D6 |
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-7074801-B1 | Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof | EISAI CO., LTD. (JP) | 2006-07-11 | — | — | US | disclosed |