Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 1/20 | 0.42 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | BRPF1 | P55201 | 7/20 | 0.39 |
| ▸ | BRD1 | O95696 | 6/20 | 0.39 |
| ▸ | BRPF3 | Q9ULD4 | 5/20 | 0.39 |
| ▸ | BRD4 | O60885 | 3/20 | 0.39 |
| ▸ | BRD9 | Q9H8M2 | 3/20 | 0.39 |
| ▸ | BRD7 | Q9NPI1 | 2/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.37 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALB | P02768 | 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 | |
|---|---|---|---|---|
| SCHEMBL28264497 | 0.86 | CDC7 (0.42) | CDC7BRPF1BRD1BRPF3BRD4 | |
| SCHEMBL10053515 | 0.80 | BRPF1 (0.45) | ENPP3CDC7BRPF1BRD1BRPF3 | |
| SCHEMBL27969722 | 0.79 | ENPP3 (0.42) | ENPP3CDC7BRPF1BRD1BRPF3 | |
| SCHEMBL1338266 | 0.76 | CDC7 (0.40) | ENPP3CDC7BRPF1BRD1BRPF3 | |
| SCHEMBL10066950 | 0.76 | CYP2A6 (0.44) | ENPP3CDC7BRPF1BRD1BRPF3 | |
| SCHEMBL6263704 | 0.76 | BRPF1 (0.42) | ENPP3CDC7BRPF1BRD1BRPF3 | |
| SCHEMBL10022422 | 0.76 | BRPF1 (0.43) | ENPP3CDC7BRPF1BRD1BRPF3 | |
| SCHEMBL21812440 | 0.75 | MCL1 (0.58) | BRPF1CYP2A6KDM4EALDH1A1MAPT | |
| SCHEMBL7443481 | 0.75 | RORC (0.45) | ENPP3CDC7BRPF1BRD1BRPF3 | |
| SCHEMBL1113031 | 0.75 | XDH (0.41) | ENPP3CDC7BRPF1BRD1BRPF3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109153643-A | Substituted indole MCL-1 inhibitors | 范德比尔特大学 | 2019-01-04 | — | — | CN | disclosed |