Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | BRD2 | P25440 | 1/20 | 0.47 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | LOX | P28300 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 4/20 | 0.41 |
| ▸ | FEN1 | P39748 | 3/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.40 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.40 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.40 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.40 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.40 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12170342 | 0.80 | ALOX5AP (0.47) | BRD4BRD2PLAUCDK5CDK5R1 | |
| SCHEMBL16509656 | 0.80 | BRD4 (0.47) | BRD4BRD2PLAUCDK5CDK5R1 | |
| Hydrochloric Acid SCHEMBL1722419 | 0.79 | ALOX5AP (0.47) | BRD4BRD2PLAUCDK5CDK5R1 | |
| Hydrochloric Acid SCHEMBL1722423 | 0.79 | ALOX5AP (0.47) | BRD4BRD2PLAUCDK5CDK5R1 | |
| SCHEMBL12189159 | 0.78 | BRD4 (0.47) | BRD4BRD2PLAUCDK5CDK5R1 | |
| SCHEMBL10282726 | 0.78 | BRD4 (0.47) | BRD4BRD2PLAUCDK5CDK5R1 | |
| SCHEMBL17600737 | 0.76 | BRD4 (0.56) | BRD4BRD2PLAULOXMMP2 | |
| SCHEMBL17600734 | 0.76 | BRD4 (0.56) | BRD4BRD2PLAULOXMMP2 | |
| SCHEMBL4610414 | 0.75 | BRD4 (0.58) | BRD4BRD2PLAULOXNAMPT | |
| SCHEMBL29287820 | 0.75 | LOX (0.50) | BRD4BRD2PLAUCDK5CDK5R1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1945632-A1 | HETEROCYCLIC MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007056341-A1 | HETEROCYCLIC MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-05-18 | — | — | WO | disclosed |