Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.31 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20341827 | 0.89 | ABL1 (0.37) | MAOAMAOBABL1HSD11B1RAB9A | |
| SCHEMBL20341862 | 0.85 | BMPR1B (0.36) | HSD11B1ALDH1A1RAB9ALMNATHRB | |
| SCHEMBL18615951 | 0.83 | BMPR1B (0.35) | ALDH1A1RAB9ALMNATHRBTAS1R3 | |
| SCHEMBL20341831 | 0.82 | MAPT (0.32) | HSD11B1ALDH1A1RAB9ACHRNA7HTR3A | |
| SCHEMBL23810222 | 0.82 | NPC1 (0.48) | ALDH1A1RAB9ALMNAMEN1KMT2A | |
| SCHEMBL20341771 | 0.81 | CTSL (0.38) | — | |
| SCHEMBL23810300 | 0.78 | KDM4E (0.35) | ALDH1A1RAB9ALMNACYP2D6MEN1 | |
| SCHEMBL23810304 | 0.77 | RAB9A (0.39) | ALDH1A1RAB9ALMNACYP2D6MEN1 | |
| SCHEMBL18616494 | 0.77 | CTSL (0.43) | — | |
| SCHEMBL20341790 | 0.76 | NAMPT (0.42) | ALDH1A1RAB9AMEN1KMT2ANPC1 |
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-2017036357-A1 | CATHEPSIN K INHIBITOR AND APPLICATION THEREOF | 广东东阳光药业有限公司 | 2017-03-09 | — | — | WO | disclosed |