Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | APLNR | P35414 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9928617 | 0.80 | AGBL2 (0.39) | AGBL2KCNH2SCN5ASCN9ASMN1; SMN2 | |
| SCHEMBL27734476 | 0.79 | HSP90AB1 (0.36) | HSP90AB1ALDH1A1SMN1; SMN2HMGCRKDM4E | |
| SCHEMBL2086658 | 0.79 | CASP1 (0.47) | ALDH1A1SMN1; SMN2L3MBTL1TSHRKMT2A | |
| SCHEMBL27598069 | 0.78 | KEAP1 (0.53) | AGBL2SCN5ASCN9AALDH1A1SMN1; SMN2 | |
| SCHEMBL31349524 | 0.78 | KEAP1 (0.53) | AGBL2SCN5ASCN9AALDH1A1SMN1; SMN2 | |
| SCHEMBL290570 | 0.78 | KEAP1 (0.53) | AGBL2SCN5ASCN9AALDH1A1SMN1; SMN2 | |
| SCHEMBL4966985 | 0.78 | ALDH1A1 (0.36) | AGBL2SCN5ASCN9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8357219 | 0.78 | SCN5A (0.36) | AGBL2SCN5ASCN9ASMN1; SMN2KMT2A | |
| SCHEMBL27286638 | 0.77 | ALDH1A1 (0.38) | AGBL2SCN5ASCN9AALDH1A1KMT2A | |
| SCHEMBL168694 | 0.77 | CASP1 (0.42) | SCN5ASCN9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005009966-A1 | NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS | PFIZER LIMITED (GB) | 2005-02-03 | — | — | WO | disclosed |