Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.36 |
| ▸ | USP2 | O75604 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.36 |
| ▸ | CASP1 | P29466 | 5/20 | 0.36 |
| ▸ | CASP7 | P55210 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | CDK7 | P50613 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8516090 | 0.92 | CYP1A2 (0.39) | CYP1A2USP2CYP3A4CASP1CASP7 | |
| SCHEMBL8365273 | 0.85 | BRD4 (0.37) | LMNAALDH1A1HIF1ACCNT1CCNE1 | |
| SCHEMBL8516687 | 0.82 | USP2 (0.33) | CYP1A2USP2CYP3A4CASP1CASP7 | |
| Trifluoroacetic Acid SCHEMBL8516758 | 0.82 | PTGDR2 (0.39) | CYP1A2USP2CYP3A4CASP1CASP7 | |
| SCHEMBL8516080 | 0.82 | USP2 (0.35) | CYP1A2USP2CYP3A4CASP1CASP7 | |
| SCHEMBL8516657 | 0.82 | PDE4B (0.32) | CCNT1CDK9 | |
| Trifluoroacetic Acid SCHEMBL8367881 | 0.81 | CYP1A2 (0.41) | CYP1A2USP2CYP3A4CASP1CASP7 | |
| SCHEMBL8517087 | 0.81 | USP2 (0.34) | CYP1A2USP2CYP3A4CASP1CASP7 | |
| SCHEMBL8516522 | 0.80 | USP2 (0.33) | CYP1A2USP2CYP3A4CASP1CASP7 | |
| SCHEMBL8367898 | 0.80 | CTSB (0.31) | CYP1A2USP2CYP3A4CASP1CASP7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999046260-A1 | NEW COMPOUNDS | ASTRAZENECA AB (SE) | 1999-09-16 | — | — | WO | claimed |
| WO-1999046260-A1 | NEW COMPOUNDS | ASTRAZENECA AB (SE) | 1999-09-16 | — | — | WO | disclosed |