Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SIRT2 | Q8IXJ6 | 5/20 | 0.45 |
| ▸ | SIRT1 | Q96EB6 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | PDE2A | O00408 | 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 | |
|---|---|---|---|---|
| SCHEMBL8285685 | 0.82 | ALDH1A1 (0.52) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL22382307 | 0.81 | KMT2A (0.63) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL25257223 | 0.80 | PTGER4 (0.42) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL12226891 | 0.80 | NPC1 (0.49) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL8284622 | 0.79 | SIRT2 (0.50) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL25828154 | 0.77 | STING1 (0.57) | — | |
| SCHEMBL8284696 | 0.76 | SIRT2 (0.48) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL22382310 | 0.76 | PTGER4 (0.63) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL30586473 | 0.76 | ALDH1A1 (0.50) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL25297307 | 0.76 | ALDH1A1 (0.50) | NPC1RAB9AMEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023131333-A1 | BENZIMIDAZOLE COMPOUND AND MEDICAL USE THEREOF | 中国科学院上海药物研究所 | 2023-07-13 | — | — | WO | disclosed |