Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LY96 | Q9Y6Y9 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 7/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7003196 | 1.00 | LY96 (0.54) | LY96CA12CA9CA1CA2 | |
| SCHEMBL7674085 | 0.92 | KMT2A (0.55) | MAPTKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL7674081 | 0.92 | KMT2A (0.55) | MAPTKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL7005500 | 0.82 | FLT3 (0.64) | CA12CA9CA1CA2MAPT | |
| SCHEMBL7676274 | 0.82 | FLT3 (0.64) | CA12CA9CA1CA2MAPT | |
| SCHEMBL6997417 | 0.81 | MAPT (0.49) | MAPTKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL7676397 | 0.81 | MAPT (0.49) | MAPTKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL7674468 | 0.81 | RAB9A (0.53) | MAPTKMT2AMEN1TP53CYP3A4 | |
| SCHEMBL7002930 | 0.81 | RAB9A (0.53) | MAPTKMT2AMEN1TP53CYP3A4 | |
| SCHEMBL7669778 | 0.77 | MAPK8 (0.56) | MAPTKMT2AMEN1ALDH1A1HPGD |
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-6414013-B1 | KINASE INHIBITORS; ANTICANCER AGENTS | PHARMACIA & UPJOHN S.P.A. (IT) | 2002-07-02 | — | — | US | claimed |