Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL842631 | 0.84 | NPC1 (0.68) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL12443609 | 0.80 | NPC1 (0.62) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL6690816 | 0.77 | CTSL (0.49) | ATMKMT2AGAASMN1; SMN2 | |
| SCHEMBL15834056 | 0.76 | MEN1 (0.63) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL14679386 | 0.76 | NPC1 (0.64) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL7055005 | 0.74 | NPC1 (0.62) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL2668066 | 0.73 | NPC1 (0.61) | NPC1RAB9AATMMEN1KMT2A | |
| SCHEMBL3319225 | 0.73 | SMN1; SMN2 (0.65) | NPC1RAB9AMEN1KMT2AGAA | |
| SCHEMBL7551492 | 0.73 | SMN1; SMN2 (0.41) | KMT2AGPR139GAASMN1; SMN2LMNA | |
| SCHEMBL6876215 | 0.73 | PAX8 (0.47) | GPR139GAASMN1; SMN2HDAC6LMNA |
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 |