Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | ATP4A | P20648 | 2/20 | 0.34 |
| ▸ | ATP4B | P51164 | 2/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11739663 | 0.89 | HRH3 (0.39) | DRD2NPC1RAB9AKMT2AHTR1A | |
| SCHEMBL11738748 | 0.86 | NPC1 (0.38) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL11738728 | 0.84 | HRH3 (0.42) | NPC1RAB9AKMT2AHRH3KDM4E | |
| SCHEMBL11743857 | 0.84 | NPC1 (0.38) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL11743478 | 0.84 | NPC1 (0.38) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL11741645 | 0.83 | NPC1 (0.42) | NPC1RAB9AKMT2ATRPM8KDM4E | |
| Hydrochloric Acid SCHEMBL11746962 | 0.83 | NPC1 (0.37) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL11737961 | 0.82 | NPC1 (0.37) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL11736431 | 0.82 | NPC1 (0.37) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL11740038 | 0.81 | NPC1 (0.39) | NPC1RAB9AKMT2ATRPM8KDM4E |
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-4033977-A | ANTIINFLAMMATORY, ANTIDEPRESSANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1977-07-05 | — | — | US | disclosed |