Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 11/20 | 0.49 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL4050738 | 1.00 | S1PR4 (0.49) | S1PR4NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL24573856 | 0.80 | TXNRD1 (0.38) | S1PR4NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL4061114 | 0.79 | S1PR4 (0.39) | S1PR4MEN1KMT2A | |
| SCHEMBL24573514 | 0.77 | PDE4A (0.34) | S1PR4 | |
| SCHEMBL6633594 | 0.76 | CA1 (0.36) | — | |
| SCHEMBL18188355 | 0.76 | S1PR4 (0.38) | S1PR4NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL18952487 | 0.75 | S1PR4 (0.62) | S1PR4NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL527357 | 0.75 | KMT2A (0.49) | S1PR4NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL187354 | 0.75 | NPC1 (0.64) | S1PR4NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL17440325 | 0.75 | KDM4E (0.43) | S1PR4ALDH1A1MEN1KMT2A |
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-2022033567-A1 | BENZIMIDAZOLE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 上海拓界生物医药科技有限公司 | 2022-02-17 | — | — | WO | disclosed |