Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | CCKAR | P32238 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 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 | |
|---|---|---|---|---|
| SCHEMBL27589491 | 0.75 | ACHE (0.42) | LTA4HCYP2D6TSHRHIF1AMCHR1 | |
| SCHEMBL9643684 | 0.74 | HRH2 (0.51) | LTA4HCYP2D6TSHRHIF1AKDM4E | |
| SCHEMBL28354366 | 0.73 | CYP2D6 (0.50) | LTA4HCYP2D6TSHRHIF1AKDM4E | |
| Lamtidine SCHEMBL534965 | 0.70 | HRH2 (0.61) | CYP2D6TSHRHIF1AHRH3LMNA | |
| SCHEMBL11098343 | 0.69 | HRH2 (0.56) | CYP2D6TSHRHIF1AHRH3LMNA | |
| SCHEMBL8813882 | 0.66 | LTA4H (0.54) | LTA4HCYP2D6TSHRHIF1AKDM4E | |
| SCHEMBL11121993 | 0.65 | HRH2 (0.45) | CYP2D6TSHRHIF1AHRH3LMNA | |
| SCHEMBL10672622 | 0.64 | KDM4E (0.30) | KDM4E | |
| SCHEMBL11093148 | 0.62 | HRH3 (0.33) | CYP2D6TSHRHIF1AHRH3CYP1A2 | |
| SCHEMBL6052629 | 0.61 | HRH3 (0.48) | TSHRKDM4EHRH3SLC6A4SLC6A2 |
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-0057564-A1 | Process for preparing 3,5-diamino-1,2,4-triazoles | SMITHKLINE BECKMAN CORPORATION (US) | 1982-08-11 | — | — | EP | disclosed |