Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 1/20 | 0.71 |
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TACR3 | P29371 | 5/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 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 | |
|---|---|---|---|---|
| SCHEMBL13385474 | 1.00 | CTSB (0.71) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL3277879 | 0.95 | CTSB (0.69) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL8248465 | 0.93 | CTSB (0.67) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL12017053 | 0.92 | CTSB (0.81) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL19093889 | 0.92 | CTSB (0.81) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL13385475 | 0.90 | CTSB (0.88) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL3049795 | 0.88 | CTSB (0.66) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL3049806 | 0.88 | CTSB (0.66) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL8285112 | 0.88 | CTSB (0.66) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL8284369 | 0.88 | CTSB (0.72) | CTSBCTSSADRB3ADRA2BADRA2C |
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-2007017144-A2 | MACROCYLIC INHIBITORS OF HEPATITIS C VIRUS | MEDIVIR AB (SE) | 2007-02-15 | — | — | WO | disclosed |