Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.67 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.57 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.56 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.56 |
| ▸ | TNF | P01375 | 1/20 | 0.56 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.56 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | GALR3 | O60755 | 1/20 | 0.55 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.55 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL23361805 | 0.88 | CXCR4 (0.68) | KMT2ACXCR4POLBTLR8CXCL8 | |
| SCHEMBL11715808 | 0.87 | CXCR4 (0.72) | KMT2ACXCR4POLBTLR8CXCL8 | |
| Bromide SCHEMBL11712562 | 0.86 | CXCR4 (0.70) | KMT2ACXCR4POLBTLR8CXCL8 | |
| SCHEMBL14247104 | 0.84 | KMT2A (0.52) | KMT2ACXCR4POLBTLR8HTT | |
| SCHEMBL30581408 | 0.82 | KMT2A (0.47) | KMT2ACXCR4POLBTLR8CXCL8 | |
| SCHEMBL6199065 | 0.82 | CXCR4 (0.85) | KMT2ACXCR4POLBTLR8CXCL8 | |
| SCHEMBL5457932 | 0.82 | KMT2A (0.56) | KMT2ACXCR4POLBTLR8CXCL8 | |
| SCHEMBL23361965 | 0.79 | NOD1 (0.56) | CXCR4POLBTLR8CXCL8NOD1 | |
| SCHEMBL25302212 | 0.79 | KMT2A (0.47) | KMT2ACXCR4POLBTLR8GRM2 | |
| SCHEMBL25294477 | 0.79 | KMT2A (0.44) | KMT2ACXCR4POLBTLR8CXCL8 |
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 |