Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 6/20 | 0.44 |
| ▸ | GRM5 | P41594 | 4/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20103129 | 0.88 | SMYD3 (0.49) | SMYD3GAAKMT2AGRM4GRM5 | |
| SCHEMBL20103437 | 0.86 | HTR2A (0.39) | GAAKMT2ASMN1; SMN2PDE4BHPGD | |
| SCHEMBL20103204 | 0.84 | PDE4B (0.44) | PDE4BHPGDTNKS2TNKS | |
| SCHEMBL18216338 | 0.83 | HPGD (0.46) | SMN1; SMN2PDE4BHPGDALDH1A1 | |
| SCHEMBL20103078 | 0.83 | HPGD (0.54) | KMT2ASMN1; SMN2GRM4PDE4BHPGD | |
| SCHEMBL20103438 | 0.83 | LMNA (0.44) | KMT2APDE4BHPGDTNKS2TNKS | |
| SCHEMBL18208311 | 0.82 | KMT2A (0.42) | KMT2APDE4BHPGDALDH1A1 | |
| SCHEMBL18208313 | 0.82 | KMT2A (0.42) | KMT2APDE4BHPGDALDH1A1 | |
| SCHEMBL18209065 | 0.82 | IRAK4 (0.49) | KDM4ETNKSHSD17B10 | |
| SCHEMBL18208502 | 0.82 | IRAK4 (0.49) | KDM4ETNKSHSD17B10 |
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-2018078005-A1 | AMIDO-SUBSTITUTED AZASPIRO DERIVATIVES AS TANKYRASE INHIBITORS | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-03 | — | — | WO | disclosed |