Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28077207 | 0.78 | ALDH1A1 (0.46) | ALOX5S1PR1MAPTKDM4ESMN1; SMN2 | |
| SCHEMBL28077336 | 0.77 | HDAC9 (0.39) | ESR1ESR2ALOX5MAPT | |
| SCHEMBL6842692 | 0.74 | TP53 (0.39) | GRM2MAP3K5S1PR1S1PR3MAPT | |
| SCHEMBL13072194 | 0.73 | RAB9A (0.50) | MAPTKDM4EPOLBHPGDCASP3 | |
| SCHEMBL28831015 | 0.72 | ALOX5 (0.62) | ALOX5KDM4E | |
| SCHEMBL6838624 | 0.71 | TP53 (0.38) | MAP3K5S1PR1S1PR3MAPTKDM4E | |
| SCHEMBL28077372 | 0.70 | SLC9A1 (0.35) | ALOX5MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL28077481 | 0.70 | TRPM8 (0.53) | ALOX5 | |
| SCHEMBL16806044 | 0.70 | ALOX5 (0.47) | GRM2ALOX5APPMAPTKDM4E | |
| SCHEMBL13520606 | 0.70 | GRM2 (0.44) | GRM2ESR1ESR2HPGDSMN1; SMN2 |
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-104334544-B | Benzimidazole proline derivative | 埃科特莱茵药品有限公司 | 2016-10-19 | — | — | CN | disclosed |