Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | NPC1L1 | Q9UHC9 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PTPRZ1 | P23471 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 1/20 | 0.34 |
| ▸ | GIPR | P48546 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | UBE2M | P61081 | 1/20 | 0.33 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 3/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6690002 | 0.89 | ALDH1A1 (0.38) | SMN1; SMN2ALDH1A1POLBL3MBTL1EPHX1 | |
| SCHEMBL6685718 | 0.84 | TDP1 (0.48) | ALDH1A1POLBL3MBTL1EPHX1 | |
| SCHEMBL6689998 | 0.77 | EPHX1 (0.48) | L3MBTL1EPHX1NPC1RAB9A | |
| SCHEMBL6688717 | 0.72 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1L3MBTL1NPC1RAB9A | |
| SCHEMBL6690797 | 0.71 | POLB (0.39) | SMN1; SMN2ALDH1A1POLBL3MBTL1EPHX1 | |
| SCHEMBL6685684 | 0.71 | KIF11 (0.39) | KIF11SMN1; SMN2ALDH1A1POLBTRPV1 | |
| SCHEMBL6690874 | 0.67 | TDP1 (0.47) | ALDH1A1POLBL3MBTL1EPHX1 | |
| SCHEMBL5534712 | 0.66 | RAB9A (0.64) | KIF11SMN1; SMN2ALDH1A1POLBL3MBTL1 | |
| SCHEMBL4795505 | 0.65 | CTSS (0.38) | KIF11ALDH1A1PTPN1PTPRZ1GCGR | |
| SCHEMBL6689996 | 0.65 | ALDH1A1 (0.35) | SMN1; SMN2ALDH1A1POLBEPHX1 |
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-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |