Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | PARP1 | P09874 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | PARP10 | Q53GL7 | 8/20 | 0.46 |
| ▸ | F7 | P08709 | 1/20 | 0.43 |
| ▸ | F3 | P13726 | 1/20 | 0.43 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.43 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.43 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.43 |
| ▸ | SIRT3 | Q9NTG7 | 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 | |
|---|---|---|---|---|
| Benzamide SCHEMBL5106831 | 0.98 | POLB (0.59) | POLBCYP3A4PARP1MAPTTSHR | |
| Benzamide SCHEMBL29283553 | 0.98 | POLB (0.59) | POLBCYP3A4PARP1MAPTTSHR | |
| Pyrazole SCHEMBL3228113 | 0.86 | CYP17A1 (0.44) | POLBCYP3A4PARP1MAPTTSHR | |
| Benzophenone SCHEMBL28959408 | 0.83 | ALDH1A1 (0.56) | MAPTTDP1L3MBTL1NPC1RAB9A | |
| Benzoic Acid SCHEMBL14918555 | 0.83 | NAPRT (0.56) | TSHRKMT2AALDH1A1MEN1 | |
| Pyrazole SCHEMBL27939408 | 0.81 | KMT2A (0.40) | POLBCYP3A4PARP1MAPTTSHR | |
| Niacinamide SCHEMBL28151345 | 0.81 | F7 (0.71) | POLBMAPTF7F3SARM1 | |
| Pyrazole SCHEMBL440249 | 0.80 | — | — | |
| Benzamidine SCHEMBL29135567 | 0.80 | F2 (0.59) | RECQLBLMF7F3KMT2A | |
| Acetophenone SCHEMBL27975101 | 0.80 | SMN1; SMN2 (0.47) | MAPTTSHRL3MBTL1NPC1RAB9A |
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-116535358-A | Benzamide derivative with sulfur-containing cyano pyrazole structure, preparation method and application thereof | 西北农林科技大学 | 2023-08-04 | — | — | CN | disclosed |