Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 3/20 | 0.48 |
| ▸ | CTSS | P25774 | 3/20 | 0.48 |
| ▸ | CTSL | P07711 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.43 |
| ▸ | TSHR | P16473 | 7/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17141146 | 0.90 | CTSL (0.51) | CTSBCTSSCTSLALDH1A1SMN1; SMN2 | |
| SCHEMBL10152374 | 0.83 | SYK (0.48) | CTSBCTSSCTSLSMN1; SMN2NPC1 | |
| SCHEMBL10151695 | 0.82 | CTSS (0.46) | CTSBCTSSCTSLTSHRALDH1A1 | |
| SCHEMBL9951765 | 0.82 | CTSS (0.46) | CTSBCTSSCTSLTSHRALDH1A1 | |
| SCHEMBL10151699 | 0.82 | CTSB (0.46) | CTSBCTSSCTSLCYP3A4ALDH1A1 | |
| SCHEMBL9951842 | 0.81 | CTSS (0.44) | CTSBCTSSCTSLTSHRALDH1A1 | |
| SCHEMBL13734005 | 0.80 | CTSL (0.47) | CTSBCTSSCTSLALDH1A1SMN1; SMN2 | |
| SCHEMBL9952383 | 0.80 | CTSB (0.44) | CTSBCTSSCTSLALDH1A1SMN1; SMN2 | |
| SCHEMBL18793707 | 0.80 | CTSB (0.55) | CTSBCTSSCTSLCYP3A4TSHR | |
| SCHEMBL24421479 | 0.79 | CA12 (0.47) | CTSBCTSSCTSLTSHRALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2654422-A1 | BICYCLO[3.2.1]OCTYL AMIDE DERIVATIVES AND USES OF SAME | H. Lundbeck A/S (DK) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012088365-A1 | BICYCLO[3.2.1]OCTYL AMIDE DERIVATIVES AND USES OF SAME | H. LUNDBECK A/S (DK) | 2012-06-28 | — | — | WO | disclosed |