Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | MET | P08581 | 1/20 | 0.31 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18547271 | 0.84 | ALDH1A1 (0.41) | NPSR1ALDH1A1KDM4ELMNAHSD17B10 | |
| SCHEMBL18547309 | 0.70 | CNR1 (0.42) | CNR1CNR2FPR2 | |
| SCHEMBL18547013 | 0.69 | CNR1 (0.42) | NPSR1ALDH1A1KDM4ELMNAHSD17B10 | |
| SCHEMBL18547268 | 0.68 | CNR1 (0.44) | MAPTNPSR1ALDH1A1LMNAHSD17B10 | |
| SCHEMBL18547342 | 0.65 | CNR1 (0.40) | NPSR1LMNAHSD17B10CNR1OPRM1 | |
| SCHEMBL18547002 | 0.65 | P2RX3 (0.45) | MAPTKDM4ELMNAHSD17B10CNR1 | |
| SCHEMBL18547281 | 0.65 | ALK (0.41) | MAPTALDH1A1KDM4ELMNAMET | |
| SCHEMBL18547274 | 0.64 | OPRM1 (0.41) | LMNACNR1CNR2OPRM1OPRK1 | |
| SCHEMBL20679656 | 0.64 | OPRM1 (0.41) | LMNACNR1CNR2OPRM1OPRK1 | |
| SCHEMBL18547273 | 0.64 | OPRM1 (0.41) | LMNACNR1CNR2OPRM1OPRK1 |
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-2017035114-A1 | BENZIMIDAZOLE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2017-03-02 | — | — | WO | disclosed |