Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.46 |
| ▸ | NOS2 | P35228 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 2/20 | 0.36 |
| ▸ | GABRD | O14764 | 2/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.36 |
| ▸ | GABRE | P78334 | 2/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.36 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.36 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.36 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL83975 | 0.82 | NOS3 (0.50) | NOS3NOS2KDM4EHSD17B10GABRP | |
| SCHEMBL31222667 | 0.82 | NOS3 (0.50) | NOS3NOS2KDM4EHSD17B10GABRP | |
| SCHEMBL14647750 | 0.80 | NOS3 (0.48) | NOS3NOS2KDM4EHSD17B10GABRP | |
| SCHEMBL4328494 | 0.80 | NOS3 (0.48) | NOS3NOS2KDM4EHSD17B10GABRP | |
| Hydrochloric Acid SCHEMBL23201276 | 0.78 | NOS3 (0.46) | NOS3NOS2KDM4EHSD17B10GABRP | |
| Hydrochloric Acid SCHEMBL30929411 | 0.78 | NOS3 (0.46) | NOS3NOS2KDM4EHSD17B10GABRP | |
| SCHEMBL27461381 | 0.78 | NOS3 (0.46) | NOS3NOS2KDM4EHSD17B10GABRP | |
| SCHEMBL23478507 | 0.78 | NOS3 (0.46) | NOS3NOS2KDM4EHSD17B10GABRP | |
| SCHEMBL6469008 | 0.78 | NOS3 (0.46) | NOS3NOS2KDM4EHSD17B10GABRP | |
| SCHEMBL24703386 | 0.77 | NOS3 (0.45) | NOS3NOS2KDM4EHSD17B10GABRP |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104981466-A | novel antibacterial compounds | JANSSEN SCIENCES IRELAND UC | 2015-10-14 | — | — | CN | disclosed |
| CN-104781250-A | New antibacterial compounds | JANSSEN SCIENCES IRELAND UC | 2015-07-15 | — | — | CN | disclosed |
| CN-102656158-B | Novel heterocyclic acrylamides and their use as pharmaceuticals | FAB PHARMA SAS | 2015-02-11 | — | — | CN | disclosed |
| CN-104119331-A | Alkenyl compound as well as use method and application thereof | GUANGDONG HEC PHARMACEUTICAL | 2014-10-29 | — | — | CN | disclosed |
| CN-103459384-A | Benzoxazepines as inhibitors of PI3K/mTOR and methods of their use and manufacture | EXELIXIS INC | 2013-12-18 | — | — | CN | disclosed |