Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKE | Q14164 | 2/20 | 0.34 |
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | VHL | P40337 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 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 | |
|---|---|---|---|---|
| SCHEMBL212096 | 0.81 | KDM4E (0.42) | NPSR1RAB9AKMT2AALDH1A1NPC1 | |
| Hydrochloric Acid SCHEMBL5691852 | 0.80 | RRM2 (0.38) | RAB9AMEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL28280233 | 0.79 | TDP1 (0.32) | RAB9AMEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL13825386 | 0.77 | CHRNB2 (0.40) | RAB9AALDH1A1KDM4EHDAC3HDAC6 | |
| SCHEMBL31199068 | 0.75 | GAA (0.40) | IKBKETBK1MEN1KMT2AALDH1A1 | |
| SCHEMBL20271757 | 0.75 | DEGS1 (0.45) | DEGS1 | |
| SCHEMBL2571391 | 0.75 | GAA (0.40) | IKBKETBK1MEN1KMT2AALDH1A1 | |
| SCHEMBL1570177 | 0.75 | HCAR3 (0.48) | IKBKETBK1RAB9ADEGS1HCAR3 | |
| SCHEMBL466003 | 0.74 | RAB9A (0.46) | RAB9AMEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL6176389 | 0.73 | ADRA2A (0.38) | NPSR1RAB9AMEN1KMT2AALDH1A1 |
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-2008071451-A1 | DIHYDROPYRIDINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-06-19 | — | — | WO | disclosed |