Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 7/20 | 0.53 |
| ▸ | DBF4 | Q9UBU7 | 7/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15064348 | 0.84 | CDC7 (0.62) | CDC7DBF4ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL15064349 | 0.79 | KDM4E (0.44) | CDC7DBF4ALDH1A1HPGDGAA | |
| SCHEMBL17054245 | 0.77 | RARA (0.49) | CDC7DBF4ALDH1A1HPGDGAA | |
| SCHEMBL15064378 | 0.74 | HPGDS (0.45) | CDC7DBF4ALDH1A1HPGDGAA | |
| SCHEMBL28719279 | 0.74 | POLB (0.66) | CDC7DBF4ALDH1A1NPSR1HPGD | |
| SCHEMBL10242419 | 0.74 | ALDH1A1 (0.61) | CDC7DBF4ALDH1A1NPSR1HPGD | |
| SCHEMBL17051059 | 0.74 | HPGDS (0.42) | CDC7DBF4ALDH1A1HPGDKDM4E | |
| SCHEMBL26638835 | 0.72 | KDM4E (0.54) | ALDH1A1NPSR1HPGDGAAKDM4E | |
| SCHEMBL975727 | 0.72 | CDC7 (0.86) | CDC7DBF4ALDH1A1NPSR1HPGD | |
| SCHEMBL976371 | 0.70 | CDC7 (0.68) | CDC7DBF4ALDH1A1NPSR1HPGD |
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-107915728-B | IAP inhibitors | 库里斯公司 | 2021-04-30 | — | — | CN | disclosed |