Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.43 |
| ▸ | RAB9A | P51151 | 10/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | METAP1 | P53582 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.37 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28202091 | 0.84 | RAB9A (0.50) | NPC1RAB9ASMN1; SMN2TP53MAPT | |
| SCHEMBL28201503 | 0.76 | NPC1 (0.41) | NPC1RAB9ASMN1; SMN2TP53MAPT | |
| SCHEMBL10608396 | 0.73 | KDM4E (0.65) | NPC1RAB9ASMN1; SMN2TP53MAPT | |
| SCHEMBL16552965 | 0.71 | MEN1 (0.54) | NPC1RAB9ASMN1; SMN2TP53MAPT | |
| SCHEMBL28201504 | 0.70 | HIF1A (0.41) | NPC1RAB9ASMN1; SMN2MAPTMEN1 | |
| SCHEMBL6394555 | 0.69 | ALDH1A1 (0.46) | NPC1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL28202092 | 0.68 | MAOA (0.47) | NPC1RAB9ASMN1; SMN2MAPTHPGD | |
| SCHEMBL26856371 | 0.68 | ALDH1A1 (0.60) | NPC1RAB9ASMN1; SMN2TP53MAPT | |
| SCHEMBL10608417 | 0.68 | MEN1 (0.48) | NPC1RAB9ASMN1; SMN2TP53MAPT | |
| SCHEMBL26011755 | 0.67 | NPC1 (0.38) | NPC1RAB9ASMN1; SMN2MAPTHPGD |
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-107602478-A | A kind of novel benzimidazoles ion monomer and preparation method thereof | 浙江大学 | 2018-01-19 | — | — | CN | disclosed |