Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22752558 | 0.85 | ESR1 (0.31) | — | |
| SCHEMBL19251352 | 0.84 | NPC1 (0.32) | NPC1MAPTRAB9A | |
| SCHEMBL12459216 | 0.82 | CYP2C19 (0.31) | — | |
| SCHEMBL19251103 | 0.79 | NPC1 (0.33) | MAOBHRH3NPC1MAPTRAB9A | |
| SCHEMBL22752577 | 0.78 | ESR1 (0.34) | — | |
| SCHEMBL22778727 | 0.76 | NPC1 (0.35) | NPC1MAPTRAB9A | |
| SCHEMBL21893106 | 0.75 | PTPN1 (0.34) | MAOBHRH3NPC1MAPTRAB9A | |
| SCHEMBL22752560 | 0.73 | NPC1 (0.33) | MAOBHRH3NPC1MAPTRAB9A | |
| SCHEMBL12523721 | 0.73 | KDM4E (0.37) | HRH3NPC1MAPTRAB9A | |
| SCHEMBL14930980 | 0.73 | NPC1 (0.34) | MAOBHRH3NPC1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-9732083-B2 | Tricyclic gyrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-08-15 | — | — | US | disclosed |