Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD38 | P28907 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MYC | P01106 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 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 | |
|---|---|---|---|---|
| SCHEMBL27800518 | 0.87 | SIRT1 (0.47) | SIRT1PARP1ALDH1A1HPGDKDM4E | |
| SCHEMBL4235369 | 0.86 | CXCR5 (0.49) | CD38CYP3A4KCNH2PARP1ALDH1A1 | |
| SCHEMBL30585075 | 0.85 | CD38 (0.46) | CD38CYP3A4KCNH2PARP1ALDH1A1 | |
| SCHEMBL27556126 | 0.84 | CYP3A4 (0.46) | CD38CYP3A4KCNH2PARP1ALDH1A1 | |
| SCHEMBL28857190 | 0.84 | CD38 (0.43) | CD38CYP3A4KCNH2PARP1ALDH1A1 | |
| SCHEMBL28204636 | 0.83 | CD38 (0.42) | CD38CYP3A4KCNH2PARP1ALDH1A1 | |
| SCHEMBL6013405 | 0.83 | CXCR5 (0.51) | CD38CYP3A4KCNH2PARP1ALDH1A1 | |
| SCHEMBL1660584 | 0.81 | PARP1 (0.46) | CD38CYP3A4KCNH2PARP1ALDH1A1 | |
| SCHEMBL8706621 | 0.81 | PARP1 (0.46) | CD38CYP3A4KCNH2PARP1ALDH1A1 | |
| SCHEMBL6013408 | 0.81 | LMNA (0.51) | CD38CYP3A4KCNH2ALDH1A1LMNA |
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-1940782-B1 | N-PHENYL PHENYLACETAMIDE NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-03-11 | — | — | EP | disclosed |