Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL695819 | 0.87 | BRD4 (0.49) | BRD4KDM4ENPC1ALDH1A1CYP1A2 | |
| SCHEMBL3131200 | 0.79 | IMPDH2 (0.57) | BRD4KDM4ENPC1ALDH1A1CYP1A2 | |
| SCHEMBL733151 | 0.79 | DYRK1A (0.47) | BRD4KDM4EHPGDGSK3BDYRK1A | |
| SCHEMBL3149953 | 0.79 | IMPDH2 (0.53) | BRD4KDM4ENPC1ALDH1A1CYP1A2 | |
| SCHEMBL1310255 | 0.78 | IMPDH2 (0.64) | BRD4KDM4ENPC1ALDH1A1CYP1A2 | |
| SCHEMBL2596719 | 0.73 | IMPDH2 (0.35) | ALDH1A1IMPDH2GPR84 | |
| SCHEMBL25328590 | 0.72 | IMPDH2 (0.34) | ALDH1A1IMPDH2GSK3BGPR84NPSR1 | |
| SCHEMBL27736804 | 0.72 | IMPDH2 (0.34) | ALDH1A1IMPDH2CCNT1CDK9GPR84 | |
| SCHEMBL3482821 | 0.71 | GPR84 (0.44) | KDM4EALDH1A1HPGDIMPDH2GPR84 | |
| SCHEMBL695859 | 0.71 | IDO1 (0.44) | BRD4KDM4EALDH1A1IMPDH2GSK3B |
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-1073443-A | Preparation method with macrolide of immunosuppressive activity | MERCK & CO INC (US) | 1993-06-23 | — | — | CN | disclosed |