Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.60 |
| ▸ | KIT | P10721 | 2/20 | 0.60 |
| ▸ | RAF1 | P04049 | 1/20 | 0.60 |
| ▸ | LCK | P06239 | 1/20 | 0.60 |
| ▸ | RET | P07949 | 1/20 | 0.60 |
| ▸ | MAP3K20 | Q9NYL2 | 1/20 | 0.60 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.60 |
| ▸ | FLT1 | P17948 | 4/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5790468 | 0.86 | KDR (0.63) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL5792920 | 0.86 | KDR (0.68) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL5794547 | 0.85 | KDR (0.60) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL633921 | 0.84 | KDR (0.64) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL14044883 | 0.83 | KDR (0.60) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL3745585 | 0.81 | KDR (0.57) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL5792923 | 0.81 | KDR (0.73) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL5792910 | 0.81 | KDR (0.73) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL5794532 | 0.81 | KDR (0.65) | KDRCYP3A4KITRAF1LCK | |
| SCHEMBL3745389 | 0.81 | KDR (0.65) | KDRCYP3A4KITRAF1LCK |
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-2006034110-A1 | (ARYLAMIDOARYL) CYANOGUANIDINE COMPOUNDS AS INHIBITORS OF C-KIT PROTO-ONCOGENE | OSI PHARMACEUTICALS, INC. (US) | 2006-03-30 | — | — | WO | disclosed |