Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.30 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.30 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.30 |
| ▸ | IKBKB | O14920 | 1/20 | 0.30 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | GYS1 | P13807 | 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 | |
|---|---|---|---|---|
| SCHEMBL16200322 | 0.71 | HCAR2 (0.35) | HCAR2MEN1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3223552 | 0.69 | LRRK2 (0.51) | CYP1A2KMT2AKDM4ETDP1ALOX15 | |
| SCHEMBL3464248 | 0.68 | CCR1 (0.52) | HCAR2MEN1CYP3A4KMT2AHSP90AA1 | |
| SCHEMBL3464623 | 0.68 | MAPK14 (0.41) | — | |
| SCHEMBL2875179 | 0.67 | AKT2 (0.50) | HCAR2MAPTKMT2ANPSR1KDM4E | |
| SCHEMBL3464192 | 0.66 | LRRK2 (0.43) | MAPK1 | |
| SCHEMBL16200330 | 0.66 | HCAR2 (0.33) | HCAR2MEN1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL16200111 | 0.66 | HCAR2 (0.33) | HCAR2 | |
| SCHEMBL16200324 | 0.66 | HCAR2 (0.33) | HCAR2MEN1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2614356 | 0.64 | IKBKB (0.50) | MEN1CYP1A2CYP3A4CYP2D6MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1720545-B1 | BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES | CHEMOCENTRYX INC (US) | 2014-10-29 | — | — | EP | disclosed |