Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KLK6 | Q92876 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12846945 | 0.78 | GAA (0.70) | GAANR2F2ALDH1A1L3MBTL1TSHR | |
| SCHEMBL20037038 | 0.78 | GAA (0.70) | GAANR2F2ALDH1A1L3MBTL1TSHR | |
| SCHEMBL20037138 | 0.76 | LMNA (0.68) | ALDH1A1LMNAHTTKLK6SMN1; SMN2 | |
| SCHEMBL20037047 | 0.76 | KLK6 (0.74) | ALDH1A1LMNAHTTKLK6SMN1; SMN2 | |
| SCHEMBL20037154 | 0.73 | KLK6 (0.59) | ALDH1A1LMNAHTTKLK6SMN1; SMN2 | |
| SCHEMBL20037114 | 0.72 | KLK6 (0.55) | ALDH1A1LMNAHTTKLK6SMN1; SMN2 | |
| SCHEMBL20037205 | 0.72 | KLK6 (0.55) | ALDH1A1LMNAHTTKLK6SMN1; SMN2 | |
| SCHEMBL20037102 | 0.72 | NPC1 (0.59) | GAAALDH1A1TSHRHSD17B10LMNA | |
| SCHEMBL9223302 | 0.70 | GAA (0.54) | GAANR2F2ALDH1A1L3MBTL1TSHR | |
| SCHEMBL4491737 | 0.69 | USP2 (0.51) | ALDH1A1L3MBTL1LMNASMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018065607-A1 | CHEMICAL SUBSTANCES WHICH INHIBIT THE ENZYMATIC ACTIVITY OF HUMAN KALLIKREIN RELATED PEPTIDASE 6 (KLK6) | Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) | 2018-04-12 | — | — | WO | disclosed |
| EP-3305781-A1 | CHEMICAL SUBSTANCES WHICH INHIBIT THE ENZYMATIC ACTIVITY OF HUMAN KALLIKREIN-RELATED PEPTIDASE 6 (KLK6) | Deutsches Krebsforschungszentrum (DE) | 2018-04-11 | — | — | EP | disclosed |