Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.37 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7938420 | 0.84 | RAB9A (0.45) | RAB9AKDM4EGAAMAPTALDH1A1 | |
| SCHEMBL6815463 | 0.82 | MEN1 (0.47) | CYP1A2CYP2C19GAAMAPTALDH1A1 | |
| SCHEMBL6815612 | 0.81 | HDAC1 (0.36) | RAB9AKDM4EGAASMN1; SMN2MAPT | |
| SCHEMBL6815779 | 0.79 | KDR (0.54) | RAB9AGAAMAPTALDH1A1HTT | |
| SCHEMBL6815032 | 0.79 | KDR (0.42) | CNR2 | |
| SCHEMBL7570589 | 0.78 | AR (0.44) | MAPT | |
| SCHEMBL6819236 | 0.78 | IRAK4 (0.39) | RAB9AKDM4EGAASMN1; SMN2TP53 | |
| SCHEMBL6816679 | 0.77 | MAPT (0.38) | CYP1A2CYP2D6CYP2C19KDM4ESMN1; SMN2 | |
| SCHEMBL6811496 | 0.76 | TSHR (0.49) | RAB9AGAASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL1091849 | 0.75 | RAB9A (0.68) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E |
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-6262082-B1 | Diaminopyridine-containing thiourea inhibitors of herpes viruses | WYETH | 2001-07-17 | — | — | US | disclosed |