Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 7/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 3/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.39 |
| ▸ | IL2 | P60568 | 1/20 | 0.38 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.38 |
| ▸ | MAP3K11 | Q16584 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 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 | |
|---|---|---|---|---|
| SCHEMBL676452 | 0.90 | CHEK1 (0.47) | CHEK1MAPTACHEALKIL2 | |
| SCHEMBL3724411 | 0.85 | MAPT (0.42) | CHEK1MAPTKDM4EALDH1A1MEN1 | |
| SCHEMBL3724510 | 0.84 | CHEK1 (0.45) | CHEK1MAPTKDM4EALDH1A1MEN1 | |
| SCHEMBL3724508 | 0.84 | CHEK1 (0.45) | CHEK1MAPTKDM4EALDH1A1MEN1 | |
| SCHEMBL676453 | 0.84 | CHEK1 (0.41) | CHEK1MAPTKDM4EALDH1A1MEN1 | |
| SCHEMBL676885 | 0.84 | CHEK1 (0.41) | CHEK1MAPTKDM4EALDH1A1MEN1 | |
| SCHEMBL3724154 | 0.83 | ALK (0.47) | MAPTALK | |
| SCHEMBL13464041 | 0.83 | CHEK1 (0.54) | CHEK1MAPTKDM4EALDH1A1LMNA | |
| SCHEMBL676451 | 0.83 | CHEK1 (0.45) | CHEK1MAPTKDM4EALDH1A1MEN1 | |
| SCHEMBL675791 | 0.82 | CHEK1 (0.55) | CHEK1MAPTACHEALKIL2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8895744-B2 | Alfa-carboline inhibitors of NPM-ALK, RET, and Bcr-Abl | UNIVERSITA' DEGLI STUDI DI MILANO-BICOCCA (IT) | 2014-11-25 | — | — | US | disclosed |
| EP-2161271-A1 | Alpha-carboline inhibitors of NMP-ALK, RET, and Bcr-Abl | Università Degli Studi Di Milano - Bicocca (IT) | 2010-03-10 | — | — | EP | disclosed |