Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | USP2 | O75604 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | IL1B | P01584 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8516085 | 0.91 | KMT2A (0.40) | PTGDR2KMT2AUSP2MEN1LMNA | |
| Trifluoroacetic Acid SCHEMBL8367881 | 0.91 | CYP1A2 (0.41) | KMT2AUSP2MEN1LMNACYP1A2 | |
| Trifluoroacetic Acid SCHEMBL8516675 | 0.87 | KMT2A (0.38) | PTGDR2KMT2AUSP2MEN1LMNA | |
| Trifluoroacetic Acid SCHEMBL8365272 | 0.84 | BRD4 (0.40) | PTGDR2KMT2ALMNAALDH1A1HIF1A | |
| Trifluoroacetic Acid SCHEMBL8517048 | 0.83 | PAX8 (0.46) | KMT2AUSP2MEN1LMNACYP1A2 | |
| Trifluoroacetic Acid SCHEMBL8515754 | 0.82 | CYP1A2 (0.40) | KMT2AUSP2MEN1LMNACYP1A2 | |
| SCHEMBL8516762 | 0.82 | CYP1A2 (0.36) | PTGDR2KMT2AUSP2MEN1LMNA | |
| Trifluoroacetic Acid SCHEMBL8365282 | 0.82 | CYP1A2 (0.44) | KMT2AUSP2MEN1LMNACYP1A2 | |
| Trifluoroacetic Acid SCHEMBL8516685 | 0.81 | MEN1 (0.40) | PTGDR2KMT2AUSP2MEN1LMNA | |
| Trifluoroacetic Acid SCHEMBL8516655 | 0.81 | TP53 (0.36) | PTGDR2KMT2AUSP2MEN1LMNA |
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 |