Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.49 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | KMO | O15229 | 1/20 | 0.49 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.49 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL126697 | 0.84 | ALDH1A1 (0.59) | HDAC8HDAC2POLBKMT2AMEN1 | |
| SCHEMBL20299899 | 0.78 | RXRA (0.49) | HDAC2HDAC1MRGPRX4NPC1RAB9A | |
| SCHEMBL6557528 | 0.75 | NPC1 (0.55) | HDAC8POLBKMT2AHDAC1MRGPRX4 | |
| SCHEMBL6555987 | 0.75 | NPSR1 (0.51) | HDAC8HDAC2POLBKMT2AMEN1 | |
| SCHEMBL17336876 | 0.75 | HDAC8 (0.64) | HDAC8POLBKMT2AMEN1NPC1 | |
| SCHEMBL7175937 | 0.74 | ALOX5 (0.66) | KMT2AMEN1MRGPRX4KMOALDH1A1 | |
| SCHEMBL29251267 | 0.74 | KMT2A (0.52) | HDAC8HDAC2POLBKMT2AMEN1 | |
| SCHEMBL27800573 | 0.72 | NPC1 (0.56) | HDAC2POLBKMT2AMEN1HDAC1 | |
| SCHEMBL27634795 | 0.72 | JAK2 (0.56) | HDAC2POLBKMT2AMEN1NPC1 | |
| SCHEMBL15901856 | 0.72 | KAT6A (0.61) | HDAC8HDAC1HDAC3NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110818598-A | Cathepsin inhibitor and preparation method and application thereof | 沈阳药科大学 | 2020-02-21 | — | — | CN | disclosed |