Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 11/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | UBE2N | P61088 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 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 | |
|---|---|---|---|---|
| SCHEMBL17927663 | 0.84 | HTR6 (0.52) | HTR6KDM4EUBE2NLMNASMN1; SMN2 | |
| SCHEMBL17927585 | 0.84 | HTR6 (0.54) | HTR6KDM4EUBE2NCA12CA9 | |
| SCHEMBL29651100 | 0.82 | HTR6 (0.64) | HTR6AKR1C3AKR1C1CA12CA9 | |
| SCHEMBL1996382 | 0.82 | HTR6 (0.64) | HTR6AKR1C3AKR1C1CA12CA9 | |
| SCHEMBL1015250 | 0.81 | HTR6 (0.58) | HTR6AKR1C3AKR1C1CA12CA9 | |
| SCHEMBL4334765 | 0.81 | HTR6 (0.52) | HTR6AKR1C3AKR1C1CA12CA9 | |
| SCHEMBL19737423 | 0.81 | HTR6 (0.59) | HTR6AKR1C3AKR1C1CA12CA9 | |
| SCHEMBL4334870 | 0.77 | HTR6 (0.65) | HTR6MEN1KMT2AHTR1ADRD2 | |
| SCHEMBL1156134 | 0.77 | PARL (0.42) | HTR6KDM4EUBE2NAKR1C3AKR1C1 | |
| SCHEMBL4781429 | 0.76 | HTR6 (0.51) | HTR6KDM4E |
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-2017216732-A1 | AZA-TANSHINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THERAPY | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2017-12-21 | — | — | WO | disclosed |