Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.47 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.44 |
| ▸ | CDK9 | P50750 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL22716841 | 1.00 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL22716682 | 0.92 | ALDH1A1 (0.53) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL16657351 | 0.89 | MAPT (0.47) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL3094959 | 0.88 | ALDH1A1 (0.55) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL28502044 | 0.88 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL2860350 | 0.88 | MAPK1 (0.58) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL4801290 | 0.88 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL29791919 | 0.88 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL10059190 | 0.88 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 | |
| SCHEMBL18425295 | 0.87 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAPOLBSMN1; SMN2 |
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-112074511-B | Substituted benzodiazoles and their use in therapy | 托马斯·黑勒戴药物研究基金会 | 2024-04-26 | — | — | CN | disclosed |