Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 14/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.53 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.53 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.52 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.52 |
| ▸ | PIM1 | P11309 | 2/20 | 0.50 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL23920228 | 1.00 | CHRM1 (0.55) | CHRM1CHRM3CHRM2CHRM4CHRM5 | |
| SCHEMBL8251733 | 0.93 | ADAMTS4 (0.50) | CHRM1CHRM3CHRM2CHRM4CHRM5 | |
| SCHEMBL22373887 | 0.93 | ADAMTS4 (0.50) | CHRM1CHRM3CHRM2CHRM4CHRM5 | |
| Trifluoroacetic Acid SCHEMBL22777600 | 0.93 | CHRM1 (0.49) | CHRM1CHRM3CHRM2CHRM4CHRM5 | |
| Trifluoroacetic Acid SCHEMBL29447008 | 0.93 | CHRM1 (0.49) | CHRM1CHRM3CHRM2CHRM4CHRM5 | |
| Trifluoroacetic Acid SCHEMBL22362359 | 0.86 | ADAMTS4 (0.45) | CHRM1CHRM3CHRM2CHRM4CHRM5 | |
| SCHEMBL22777445 | 0.85 | RAB9A (0.54) | HDAC3HDAC1HDAC2HDAC4HDAC7 | |
| SCHEMBL29447009 | 0.85 | RAB9A (0.54) | HDAC3HDAC1HDAC2HDAC4HDAC7 | |
| SCHEMBL22777444 | 0.85 | RAB9A (0.54) | HDAC3HDAC1HDAC2HDAC4HDAC7 | |
| SCHEMBL21062361 | 0.83 | RAB9A (0.57) | HDAC3HDAC1HDAC2HDAC4HDAC7 |
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 |