Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 8/20 | 0.42 |
| ▸ | NOS3 | P29474 | 6/20 | 0.42 |
| ▸ | NOS1 | P29475 | 5/20 | 0.41 |
| ▸ | GABRP | O00591 | 4/20 | 0.41 |
| ▸ | GABRD | O14764 | 4/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.41 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.41 |
| ▸ | GABRE | P78334 | 4/20 | 0.41 |
| ▸ | GABRA6 | Q16445 | 4/20 | 0.41 |
| ▸ | GABRG1 | Q8N1C3 | 4/20 | 0.41 |
| ▸ | GABRG3 | Q99928 | 4/20 | 0.41 |
| ▸ | GABRQ | Q9UN88 | 4/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18315118 | 0.79 | NOS2 (0.45) | NOS2NOS3NOS1GABRPGABRD | |
| SCHEMBL22029038 | 0.78 | NOS2 (0.37) | NOS2NOS3NOS1GABRPGABRD | |
| SCHEMBL17232460 | 0.78 | NOS2 (0.44) | NOS2NOS3NOS1GABRPGABRD | |
| SCHEMBL17236140 | 0.76 | NOS2 (0.42) | NOS2NOS3NOS1GABRPGABRD | |
| Hydrochloric Acid SCHEMBL17224997 | 0.74 | NOS2 (0.41) | NOS2NOS3NOS1GABRPGABRD | |
| SCHEMBL34472590 | 0.74 | KDM4E (0.50) | — | |
| SCHEMBL16093699 | 0.74 | NOS2 (0.44) | NOS2NOS3NOS1GABRPGABRD | |
| Hydrochloric Acid SCHEMBL18300562 | 0.73 | NOS2 (0.40) | NOS2NOS3NOS1GABRPGABRD | |
| SCHEMBL18310637 | 0.73 | NOS2 (0.40) | NOS2NOS3NOS1GABRPGABRD | |
| SCHEMBL18310671 | 0.73 | NOS2 (0.40) | NOS2NOS3NOS1GABRPGABRD |
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-2016201052-A1 | BRIDGED BICYCLIC KALLIKREIN INHIBITORS | GLOBAL BLOOD THERAPEUTICS, INC. (US) | 2016-12-15 | — | — | WO | disclosed |