Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 5/20 | 0.53 |
| ▸ | NOD2 | Q9HC29 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18332162 | 0.89 | NOD1 (0.51) | NOD1NOD2KDM4ELMNATSHR | |
| SCHEMBL18332154 | 0.89 | NOD2 (0.69) | NOD1NOD2KDM4ELMNATSHR | |
| SCHEMBL18331912 | 0.88 | NOD1 (0.53) | NOD1NOD2KDM4ELMNATSHR | |
| SCHEMBL18331914 | 0.86 | NOD1 (0.53) | NOD1NOD2KDM4ELMNATSHR | |
| SCHEMBL10002821 | 0.85 | NOD1 (0.57) | NOD1NOD2KDM4ELMNATSHR | |
| SCHEMBL10002626 | 0.84 | NOD1 (0.61) | NOD1NOD2KDM4ELMNATSHR | |
| SCHEMBL14627380 | 0.81 | NOD1 (0.78) | NOD1NOD2LMNAALOX5OPRM1 | |
| SCHEMBL18332156 | 0.80 | NOD1 (0.44) | NOD1NOD2KDM4ELMNATSHR | |
| SCHEMBL18331705 | 0.80 | NOD1 (0.47) | NOD1NOD2KDM4ELMNATSHR | |
| SCHEMBL10003470 | 0.80 | NOD2 (0.51) | NOD1NOD2KDM4ELMNATSHR |
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-2016204261-A1 | AMINOPYRAZOLE DERIVATIVES | 中外製薬株式会社 | 2016-12-22 | — | — | WO | disclosed |