Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.47 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 3/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.44 |
| ▸ | ATF4 | P18848 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30685468 | 1.00 | RAB9A (0.47) | RAB9ANPC1L3MBTL1SMPD1CNR1 | |
| SCHEMBL29082305 | 1.00 | RAB9A (0.47) | RAB9ANPC1L3MBTL1SMPD1CNR1 | |
| SCHEMBL29082691 | 0.85 | SMPD1 (0.50) | RAB9ANPC1L3MBTL1SMPD1CNR1 | |
| SCHEMBL30685470 | 0.85 | SMPD1 (0.50) | RAB9ANPC1L3MBTL1SMPD1CNR1 | |
| SCHEMBL29082693 | 0.85 | SMPD1 (0.50) | RAB9ANPC1L3MBTL1SMPD1CNR1 | |
| SCHEMBL29082315 | 0.82 | TNKS (0.40) | RAB9ANPC1L3MBTL1SMPD1CNR1 | |
| SCHEMBL29082318 | 0.82 | TNKS (0.40) | RAB9ANPC1L3MBTL1SMPD1CNR1 | |
| SCHEMBL29082667 | 0.80 | NPC1 (0.49) | RAB9ANPC1SMPD1CNR1SMYD3 | |
| SCHEMBL24225649 | 0.79 | RAB9A (0.58) | RAB9ANPC1L3MBTL1SMYD3ATF4 | |
| SCHEMBL21050136 | 0.79 | RAB9A (0.58) | RAB9ANPC1L3MBTL1SMYD3ATF4 |
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-116768877-A | ISR inhibitor and preparation method and application thereof | 中国药科大学 | 2023-09-19 | — | — | CN | disclosed |