Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 6/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28329422 | 0.84 | ELANE (0.58) | ELANETDP1PDE4AKCNH2HTT | |
| SCHEMBL20240716 | 0.83 | TDP1 (0.59) | ELANETDP1HTTLMNAKDM4E | |
| SCHEMBL28735738 | 0.82 | PDE4A (0.49) | TDP1PDE4AKCNH2LMNAKDM4E | |
| SCHEMBL10999222 | 0.82 | ALDH1A1 (0.57) | HTTLMNAKDM4EMEN1NPC1 | |
| SCHEMBL2970319 | 0.81 | ELANE (0.52) | ELANETDP1PDE4AKCNH2HTT | |
| SCHEMBL7185413 | 0.80 | PDE4A (0.65) | ELANETDP1PDE4AKCNH2KDM4E | |
| SCHEMBL7192676 | 0.79 | ELANE (0.58) | ELANETDP1PDE4AKCNH2LMNA | |
| SCHEMBL7179542 | 0.79 | PDE4A (0.55) | ELANETDP1PDE4AKCNH2KDM4E | |
| SCHEMBL7953666 | 0.79 | ELANE (0.58) | ELANETDP1MAOBCLEC4MTSHR | |
| SCHEMBL7175985 | 0.79 | ELANE (0.50) | ELANETDP1PDE4AKCNH2HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-110475777-B | Novel pyrido [2,3-b ] indole compounds for the treatment and prevention of bacterial infections | 豪夫迈·罗氏有限公司 | 2022-04-15 | — | — | CN | disclosed |