Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.40 |
| ▸ | NPY2R | P49146 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8370509 | 0.80 | CASP3 (0.48) | CDK4ALDH1A1MAPTGAACASP3 | |
| SCHEMBL8369468 | 0.75 | MALT1 (0.45) | ALDH1A1KDM4EHPGDADORA2BADORA1 | |
| SCHEMBL8367302 | 0.73 | CDK4 (0.56) | CDK4ALDH1A1MAPTKDM4ECASP3 | |
| SCHEMBL8367296 | 0.72 | S100A4 (0.39) | ALDH1A1MAPTGAAKDM4EHPGD | |
| SCHEMBL8369500 | 0.71 | ALDH1A1 (0.44) | ALDH1A1MAPTGAAKDM4EHPGD | |
| SCHEMBL8369531 | 0.71 | CASP3 (0.51) | CDK4ALDH1A1MAPTGAACASP3 | |
| SCHEMBL8548036 | 0.71 | CDK4 (0.64) | CDK4ALDH1A1MAPTKDM4ECASP3 | |
| SCHEMBL8368659 | 0.69 | MAPT (0.48) | CDK4ALDH1A1MAPTKDM4ECASP3 | |
| SCHEMBL7469678 | 0.67 | SYK (0.56) | CDK4ALDH1A1MAPTGAAKDM4E | |
| SCHEMBL8371662 | 0.67 | CDK4 (0.50) | CDK4ALDH1A1MAPTGAATP53 |
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-1999052365-A1 | ANTICANCER AGENTS | ELI LILLY AND COMPANY (US) | 1999-10-21 | — | — | WO | disclosed |