Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL578222 | 0.86 | POLB (0.38) | MEN1KMT2APOLBTSHRGAA | |
| SCHEMBL30581462 | 0.80 | POLB (0.34) | MEN1KMT2APOLBTSHRNPSR1 | |
| SCHEMBL4148573 | 0.80 | POLB (0.39) | MEN1KMT2APOLBTSHRGAA | |
| SCHEMBL15565518 | 0.79 | HTR2A (0.42) | MEN1KMT2APOLBHDAC1TSHR | |
| SCHEMBL2534198 | 0.78 | TSHR (0.40) | MEN1KMT2APOLBTSHRGAA | |
| SCHEMBL22278267 | 0.74 | MAPT (0.41) | MEN1KMT2APOLBHDAC1HDAC6 | |
| SCHEMBL12229721 | 0.73 | TDP1 (0.38) | MEN1KMT2APOLBTSHRNPSR1 | |
| SCHEMBL12229748 | 0.73 | POLB (0.34) | MEN1KMT2APOLBTSHRGAA | |
| SCHEMBL12229694 | 0.72 | TDP1 (0.39) | MEN1KMT2APOLBTSHRNPSR1 | |
| SCHEMBL895236 | 0.72 | ALDH1A1 (0.47) | MEN1KMT2APOLBTSHRGAA |
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 |