Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | DNM2 | P50570 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | VHL | P40337 | 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 | |
|---|---|---|---|---|
| SCHEMBL6688717 | 0.86 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1NPC1RAB9ATSHR | |
| SCHEMBL6690002 | 0.74 | ALDH1A1 (0.38) | POLBSMN1; SMN2ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL6685688 | 0.71 | KIF11 (0.38) | POLBSMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL6685718 | 0.71 | TDP1 (0.48) | POLBALDH1A1L3MBTL1EPHX2EPHX1 | |
| SCHEMBL6689998 | 0.71 | EPHX1 (0.48) | NPC1RAB9AL3MBTL1EPHX1 | |
| SCHEMBL6690789 | 0.68 | NPC1 (0.34) | SMN1; SMN2ALDH1A1NPC1RAB9ATSHR | |
| SCHEMBL14895368 | 0.64 | EPHX1 (0.42) | L3MBTL1EPHX1 | |
| SCHEMBL4796551 | 0.62 | F2RL1 (0.42) | SMN1; SMN2ALDH1A1IDO1F2RL1VHL | |
| SCHEMBL12261573 | 0.61 | CHRNB2 (0.39) | POLBSMN1; SMN2NPC1RAB9ATSHR | |
| SCHEMBL14167186 | 0.60 | ALOX5 (0.41) | EPHX1 |
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 |