Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.31 |
| ▸ | CCR3 | P51677 | 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 | |
|---|---|---|---|---|
| SCHEMBL6686689 | 0.91 | ALDH1A1 (0.36) | RAB9ANPC1POLBOPRL1ALDH1A1 | |
| SCHEMBL6690873 | 0.90 | RAB9A (0.40) | RAB9ANPC1POLBOPRL1ALDH1A1 | |
| SCHEMBL6685923 | 0.86 | RAB9A (0.38) | RAB9ANPC1POLBSMN1; SMN2 | |
| SCHEMBL6693491 | 0.84 | NPC1 (0.42) | RAB9ANPC1ALDH1A1SMN1; SMN2HTT | |
| SCHEMBL6693494 | 0.84 | SLC6A9 (0.37) | RAB9ANPC1PARP10 | |
| SCHEMBL6687208 | 0.82 | TRPA1 (0.35) | OPRL1ALDH1A1PARP10MEN1KMT2A | |
| SCHEMBL6686989 | 0.80 | BTK (0.35) | RAB9ANPC1OPRL1ALDH1A1TSHR | |
| SCHEMBL6685681 | 0.79 | EPHX2 (0.48) | RAB9ANPC1POLBALDH1A1TSHR | |
| SCHEMBL6685728 | 0.79 | RAB9A (0.39) | RAB9ANPC1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL6688322 | 0.79 | TP53 (0.43) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 |
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 |