Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.57 |
| ▸ | BRD2 | P25440 | 1/20 | 0.57 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.50 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.50 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.50 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.50 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.50 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.50 |
| ▸ | PLAU | P00749 | 1/20 | 0.48 |
| ▸ | LOX | P28300 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 2/20 | 0.47 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4610414 | 0.87 | BRD4 (0.58) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL6302770 | 0.85 | BRD4 (0.57) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL5885963 | 0.85 | BRD4 (0.57) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL5885959 | 0.85 | BRD4 (0.57) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL1684457 | 0.85 | BRD4 (0.57) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL1684459 | 0.85 | BRD4 (0.57) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL15256572 | 0.85 | BRD4 (0.57) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL19563388 | 0.85 | BRD4 (0.57) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL28243010 | 0.85 | TRPA1 (0.61) | BRD4BRD2PSEN1PSEN2APH1B | |
| SCHEMBL17600734 | 0.85 | BRD4 (0.56) | BRD4BRD2PSEN1PSEN2APH1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2395002-A1 | Pharmaceutical composition containing a heterocyclic modulator of ATP-binding cassette transporters. | Vertex Pharmaceuticals Incorporated (US) | 2011-12-14 | — | — | EP | disclosed |