Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 3/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12963909 | 0.94 | ADORA1 (0.38) | ADORA1TMIGD3TSHRPBK | |
| SCHEMBL3949386 | 0.81 | BRD4 (0.40) | ADORA1ADORA3ADORA2ANPC1RAB9A | |
| SCHEMBL3950357 | 0.80 | JAK3 (0.38) | ADORA2BADORA1ADORA3ADORA2ANPC1 | |
| SCHEMBL3949234 | 0.79 | TSPO (0.38) | ADORA1ADORA3ADORA2ANPC1RAB9A | |
| SCHEMBL3949356 | 0.78 | ADORA3 (0.39) | ADORA1ADORA3ADORA2ANOS1NOS2 | |
| SCHEMBL3952234 | 0.78 | ADORA3 (0.36) | ADORA1ADORA3ADORA2ANPC1RAB9A | |
| SCHEMBL3952077 | 0.78 | MAPT (0.38) | ADORA1ADORA3ADORA2ANPC1RAB9A | |
| SCHEMBL3948904 | 0.78 | PDK2 (0.37) | ADORA1ADORA3ADORA2ANPC1RAB9A | |
| SCHEMBL30633389 | 0.78 | ADORA3 (0.39) | ADORA1ADORA3ADORA2ANOS1NOS2 | |
| SCHEMBL3950073 | 0.77 | ADORA3 (0.34) | ADORA1ADORA3ADORA2ANPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009029592-A1 | HETEROBICYCLIC-SUBSTITUTED QUINOLONES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | KALYPSYS, INC. (US) | 2009-03-05 | — | — | WO | disclosed |
| WO-2009029592-A1 | HETEROBICYCLIC-SUBSTITUTED QUINOLONES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | KALYPSYS, INC. (US) | 2009-03-05 | — | — | WO | disclosed |