Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL8264968 | 0.86 | AAK1 (0.38) | AAK1MEN1KMT2ASMN1; SMN2NPSR1 | |
| SCHEMBL1067557 | 0.85 | AAK1 (0.44) | AAK1MEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL5928301 | 0.76 | MEN1 (0.51) | AAK1MEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL28269146 | 0.74 | AAK1 (0.53) | AAK1MEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL17005451 | 0.74 | AAK1 (0.49) | AAK1MEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL14493754 | 0.73 | AAK1 (0.54) | AAK1MEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL1883501 | 0.73 | AAK1 (0.52) | AAK1MEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL1688571 | 0.73 | AAK1 (0.57) | AAK1MEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL1064740 | 0.72 | MEN1 (0.43) | AAK1MEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL28269131 | 0.72 | AAK1 (0.51) | AAK1MEN1KMT2ANPC1SMN1; SMN2 |
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-2006064286-A1 | CATHEPSIN S INHIBITORS | MEDIVIR UK LTD (GB) | 2006-06-22 | — | — | WO | disclosed |